SCHEMBL831692

SCHEMBL831692

CC(C(=O)O)C(N)c1ccc(Cl)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 0.52
CYP2C9 P11712 5/20 0.49
CYP2C19 P33261 4/20 0.49
MEN1 O00255 2/20 0.49
CYP2D6 P10635 2/20 0.49
KMT2A Q03164 2/20 0.49
POLB P06746 2/20 0.45
BRD4 O60885 1/20 0.44
GABBR2 O75899 3/20 0.43
GABBR1 Q9UBS5 3/20 0.43
LMNA P02545 2/20 0.43
TSHR P16473 2/20 0.43
FFAR2 O15552 1/20 0.43
CYP3A4 P08684 1/20 0.43
ADORA3 P0DMS8 1/20 0.43
NFKB1 P19838 1/20 0.43
DRD3 P35462 1/20 0.43
BLM P54132 1/20 0.43
CYP1A2 P05177 1/20 0.43
THRB P10828 1/20 0.43

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
SCHEMBL16967416 1.00 ADRB2 (0.52) ADRB2CYP2C9CYP2C19MEN1CYP2D6
SCHEMBL16967393 1.00 ADRB2 (0.52) ADRB2CYP2C9CYP2C19MEN1CYP2D6
Hydrochloric Acid SCHEMBL20521971 0.98 ADRB2 (0.50) ADRB2CYP2C9CYP2C19MEN1CYP2D6
Hydrochloric Acid SCHEMBL20521974 0.98 ADRB2 (0.50) ADRB2CYP2C9CYP2C19MEN1CYP2D6
SCHEMBL25178201 0.82 ESR1 (0.46) CYP2C9CYP2C19MEN1CYP2D6KMT2A
SCHEMBL5862033 0.82 DPP4 (0.54) CYP2D6LMNA
SCHEMBL16967371 0.82 DPP4 (0.54) CYP2D6LMNA
SCHEMBL3886489 0.82 DPP4 (0.54) CYP2D6LMNA
SCHEMBL804233 0.82 DPP4 (0.54) CYP2D6LMNA
SCHEMBL4674647 0.82 DPP4 (0.54) CYP2D6LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4301875-A1 BIOMARKERS FOR CANCER THERAPY USING MDM2 ANTAGONISTS Otsuka Pharmaceutical Co., Ltd. (JP) 2024-01-10 EP disclosed
US-20230338337-A1 BIOMARKERS FOR CANCER THERAPY USING MDM2 ANTAGONISTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2023-10-26 US disclosed
US-20230313313-A1 BIOMARKERS FOR CANCER THERAPY USING MDM2 ANTAGONISTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2023-10-05 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
EP-4204812-A2 BIOMARKERS FOR CANCER THERAPY USING MDM2 ANTAGONISTS Otsuka Pharmaceutical Co., Ltd. (JP) 2023-07-05 EP disclosed
EP-4151633-A1 INTERMEDIATES OF ISOINDOLINONE INHIBITORS OF THE MDM2-P53 INTERACTION HAVING ANTICANCER ACTIVITY Astex Therapeutics Limited (GB) 2023-03-22 EP disclosed
US-11603367-B2 Isoindolinone inhibitors of the MDM2-P53 interaction and process for making them ASTEX THERAPEUTICS LIMITED (GB) 2023-03-14 US disclosed
WO-2022185260-A1 BIOMARKERS FOR CANCER THERAPY USING MDM2 ANTAGONISTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2022-09-09 WO disclosed
WO-2022043930-A2 BIOMARKERS FOR CANCER THERAPY USING MDM2 ANTAGONISTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2022-03-03 WO disclosed
US-11236047-B2 Combination of isoindolinone derivatives with SGI-110 ASTEX THERAPEUTICS LIMITED (GB) 2022-02-01 US disclosed
EP-3601272-A1 ISOINDOLINONE INHIBITORS OF THE MDM2-P53 INTERACTION AND PROCESS FOR MAKING THEM Astex Therapeutics Limited (GB) 2020-02-05 EP disclosed
US-10544132-B2 Isoindolinone inhibitors of the MDM2-p53 interaction having anticancer activity ASTEX THERAPEUTICS LIMITED (GB) 2020-01-28 US disclosed
US-20190016708-A1 ISOINDOLINONE INHIBITORS OF THE MDM2-P53 INTERACTION HAVING ANTICANCER ACTIVITY ASTEX THERAPEUTICS LIMITED (GB) 2019-01-17 US disclosed
WO-2018178691-A1 ISOINDOLINONE INHIBITORS OF THE MDM2-P53 INTERACTION AND PROCESS FOR MAKING THEM ASTEX THERAPEUTICS LIMITED (GB) 2018-10-04 WO disclosed
WO-2018178679-A1 COMBINATION OF ISOINDOLINONE DERIVATIVES WITH SGI-110 ASTEX THERAPEUTICS LIMITED (GB) 2018-10-04 WO disclosed
EP-3356350-A1 ISOINDOLINONE INHIBITORS OF THE MDM2-P53 INTERACTION HAVING ANTICANCER ACTIVITY Astex Therapeutics Limited (GB) 2018-08-08 EP disclosed
US-8143411-B2 Substituted 6-phenylnicotinic acids and their use BAYER ANIMAL HEALTH GMBH (DE) 2012-03-27 US disclosed
US-20100234432-A1 Substituted 6-phenylnicotinic acids and their use BAYER ANIMAL HEALTH GMBH (DE) 2010-09-16 US disclosed
US-7041667-B1 CCR5 modulators PFIZER, INC. (US) 2006-05-09 US disclosed
EP-1013276-A1 Aminoazacycloalkanes as CCR5 modulators PFIZER INC. (US) 2000-06-28 EP 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 (8 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-10544132-B2 Isoindolinone inhibitors of the MDM2-p53 interaction having anticancer activity TP53, MDM2, TP53BP1 ADRB2 3848/4885CYP2C9 2188/4885CYP2C19 2466/4885
US-20230313313-A1 BIOMARKERS FOR CANCER THERAPY USING MDM2 ANTAGONISTS SKP2, MDM2, TP53 ADRB2 4183/4885CYP2C9 4773/4885CYP2C19 4690/4885
US-20100234432-A1 Substituted 6-phenylnicotinic acids and their use SLC5A6, FABP3, NAPRT ADRB2 2046/4885CYP2C9 1315/4885CYP2C19 1637/4885
US-11603367-B2 Isoindolinone inhibitors of the MDM2-P53 interaction and process for making them MDM2, TP53, TP53BP1 ADRB2 3341/4885CYP2C9 1924/4885CYP2C19 1987/4885
US-20230338337-A1 BIOMARKERS FOR CANCER THERAPY USING MDM2 ANTAGONISTS IRF2BP2, BST2, IRF3 ADRB2 2880/4885CYP2C9 4734/4885CYP2C19 4737/4885
US-11236047-B2 Combination of isoindolinone derivatives with SGI-110 SGK3, SGK2, GDI2 ADRB2 420/4885CYP2C9 443/4885CYP2C19 1023/4885
US-20230278989-A1 ISOINDOLINONE INHIBITORS OF THE MDM2-P53 INTERACTION AND PROCESS FOR MAKING THEM MDM2, TP53, TP53BP1 ADRB2 3341/4885CYP2C9 1924/4885CYP2C19 1987/4885
US-20190016708-A1 ISOINDOLINONE INHIBITORS OF THE MDM2-P53 INTERACTION HAVING ANTICANCER ACTIVITY TP53, MDM2, TP53BP1 ADRB2 3848/4885CYP2C9 2188/4885CYP2C19 2466/4885

“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.