SCHEMBL452681

SCHEMBL452681

CC1CCN(c2ncccn2)CC1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.56
CYP2C19 P33261 1/20 0.56
ACHE P22303 4/20 0.50
KMT2A Q03164 4/20 0.50
ALDH1A1 P00352 2/20 0.50
TSHR P16473 2/20 0.50
MEN1 O00255 2/20 0.50
PKM P14618 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.49
LMNA P02545 2/20 0.48
MAPT P10636 2/20 0.48
GPR119 Q8TDV5 2/20 0.47
USP2 O75604 2/20 0.46
POLB P06746 1/20 0.46
RAB9A P51151 1/20 0.44
GAA P10253 1/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Ammonia Solution, Strong SCHEMBL8131352 0.98 KDM4E (0.55) KDM4ECYP2C19ACHEKMT2AALDH1A1
Hydrochloric Acid SCHEMBL8127064 0.96 KDM4E (0.53) KDM4ECYP2C19ACHEKMT2AALDH1A1
SCHEMBL26700624 0.88 DYRK1A (0.49) KDM4ECYP2C19ACHEKMT2AALDH1A1
SCHEMBL13703144 0.88 DYRK1A (0.49) KDM4ECYP2C19ACHEKMT2AALDH1A1
SCHEMBL12523970 0.79 GPR119 (0.50) KDM4EACHEKMT2AALDH1A1TSHR
SCHEMBL26157097 0.79 TSHR (0.46) ACHEKMT2AALDH1A1TSHRMEN1
SCHEMBL15133278 0.79 KDM4E (0.49) KDM4ECYP2C19ALDH1A1LMNAMAPT
SCHEMBL2070684 0.78 KDM4E (0.56) KDM4ECYP2C19KMT2AALDH1A1TSHR
SCHEMBL452680 0.78 KDM4E (0.56) KDM4ECYP2C19KMT2AALDH1A1TSHR
SCHEMBL1874079 0.78 KDM4E (0.61) KDM4ECYP2C19KMT2AALDH1A1TSHR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 125 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11753397-B2 Cereblon binders for the degradation of ikaros C4 THERAPEUTICS, INC. (US) 2023-09-12 US disclosed
US-20230278989-A1 ISOINDOLINONE INHIBITORS OF THE MDM2-P53 INTERACTION AND PROCESS FOR MAKING THEM ASTEX THERAPEUTICS LIMITED (GB) 2023-09-07 US disclosed
US-20230278989-A1 ISOINDOLINONE INHIBITORS OF THE MDM2-P53 INTERACTION AND PROCESS FOR MAKING THEM ASTEX THERAPEUTICS LIMITED (GB) 2023-09-07 US disclosed
WO-2023093728-A1 BRM SELECTIVE DEGRADATION AGENT COMPOUND AND USE THEREOF 江苏先声药业有限公司 2023-06-01 WO disclosed
US-11236047-B2 Combination of isoindolinone derivatives with SGI-110 ASTEX THERAPEUTICS LIMITED (GB) 2022-02-01 US disclosed
US-11021470-B2 2-substituted quinazoline compounds comprising a substituted heterocyclic group and methods of use thereof ARAXES PHARMA LLC (US) 2021-06-01 US disclosed
US-20210101887-A1 ISOINDOLINONE INHIBITORS OF THE MDM2-P53 INTERACTION AND PROCESS FOR MAKING THEM ASTEX THERAPEUTICS LIMITED (GB) 2021-04-08 US disclosed
US-20210009559-A1 CEREBLON BINDERS FOR THE DEGRADATION OF IKAROS C4 THERAPEUTICS, INC. (US) 2021-01-14 US disclosed
US-20200207711-A1 COMBINATION OF ISOINDOLINONE DERIVATIVES WITH SGI-110 ASTEX THERAPEUTICS LIMITED (GB) 2020-07-02 US disclosed
US-20200181123-A1 2-SUBSTITUTED QUINAZOLINE COMPOUNDS COMPRISING A SUBSTITUTED HETEROCYCLIC GROUP AND METHODS OF USE THEREOF ARAXES PHARMA LLC 2020-06-11 US disclosed
US-20070135477-A1 Benzimidazole derivatives and their use as protein kinases inhibitors ASTEX THERAPEUCTICS, LIMITED (US) 2007-06-14 US disclosed
WO-2007046550-A1 PYRAZOLE COMPOUNDS HAVING CANNABINOID RECEPTOR (CB1) ANTAGONIZING ACTIVITY MITSUBISHI TANABE PHARMA CORPORATION (JP) 2007-04-26 WO disclosed
WO-2006077424-A1 PHARMACEUTICAL COMPOUNDS ASTEX THERAPEUTICS LIMITED (GB) 2006-07-27 WO disclosed
WO-2006077428-A1 PHARMACEUTICAL COMPOUNDS ASTEX THERAPEUTICS LIMITED (GB) 2006-07-27 WO disclosed
WO-2006077414-A1 PYRAZOLE DERIVATIVES FOR THE INHIBITION OF CDK' S AND GSK' S ASTEX THERAPEUTICS LIMITED (GB) 2006-07-27 WO disclosed
WO-2006077425-A1 COMBINATIONS OF PYRAZOLE KINASE INHIBITORS AND FURTHER ANTITUMOR AGENTS ASTEX THERAPEUTICS LIMITED (GB) 2006-07-27 WO disclosed
WO-2006070192-A1 THIAZOLE AND ISOTHIAZOLE DERIVATIVES THAT MODULATE THE ACIVITY OF CDK, GSK AND AURORA KYNASES ASTEX THERAPEUTICS LIMITED (GB) 2006-07-06 WO disclosed
WO-2005002552-A2 BENZIMIDAZOLE DERIVATIVES AND THEIR USE AS PROTEIN KINASES INHIBITORS ASTEX THERAPEUTICS LIMITED (GB) 2005-01-13 WO disclosed
WO-2004066960-A2 COMBINATION OF H1, H3 AND H4 RECEPTOR ANTAGONISTS FOR TREATMENT OF ALLERGIC AND NON-ALLERGIC PULMONARY INFLAMMATION, CONGESTION AND ALLERGIC RHINITIS SCHERING CORPORATION (US) 2004-08-12 WO disclosed
WO-2004037809-A1 TRIAZOLE COMPOUNDS FOR THE TREATMENT OF DYSMENORRHOEA PFIZER LIMITED (GB) 2004-05-06 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (9 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11753397-B2 Cereblon binders for the degradation of ikaros CRBN, IKZF1, IKZF3 KDM4E 486/4885CYP2C19 4827/4885ACHE 3575/4885
US-11236047-B2 Combination of isoindolinone derivatives with SGI-110 SGK3, SGK2, GDI2 KDM4E 4490/4885CYP2C19 1023/4885ACHE 1189/4885
US-20230278989-A1 ISOINDOLINONE INHIBITORS OF THE MDM2-P53 INTERACTION AND PROCESS FOR MAKING THEM MDM2, TP53, TP53BP1 KDM4E 3104/4885CYP2C19 1987/4885ACHE 3642/4885
US-20210009559-A1 CEREBLON BINDERS FOR THE DEGRADATION OF IKAROS CRBN, IKZF1, IKZF3 KDM4E 543/4885CYP2C19 4834/4885ACHE 2387/4885
US-20070135477-A1 Benzimidazole derivatives and their use as protein kinases inhibitors CDK1, AURKA, CDK2 KDM4E 828/4885CYP2C19 2035/4885ACHE 3364/4885
US-20200207711-A1 COMBINATION OF ISOINDOLINONE DERIVATIVES WITH SGI-110 SGK3, SGK2, GDI2 KDM4E 4490/4885CYP2C19 1023/4885ACHE 1189/4885
US-20200181123-A1 2-SUBSTITUTED QUINAZOLINE COMPOUNDS COMPRISING A SUBSTITUTED HETEROCYCLIC GROUP AND METHODS OF USE THEREOF KRAS, NRAS, HRAS KDM4E 3328/4885CYP2C19 1550/4885ACHE 3455/4885
US-11021470-B2 2-substituted quinazoline compounds comprising a substituted heterocyclic group and methods of use thereof KRAS, NRAS, HRAS KDM4E 3328/4885CYP2C19 1550/4885ACHE 3455/4885
US-20210101887-A1 ISOINDOLINONE INHIBITORS OF THE MDM2-P53 INTERACTION AND PROCESS FOR MAKING THEM MDM2, TP53, TP53BP1 KDM4E 3104/4885CYP2C19 1987/4885ACHE 3642/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.