SCHEMBL8830833

SCHEMBL8830833

CNC(=O)Nc1cccc(Cl)c1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 9/20 0.79
MEN1 O00255 8/20 0.79
MAPT P10636 7/20 0.79
LMNA P02545 6/20 0.79
HTT P42858 3/20 0.79
ALDH1A1 P00352 2/20 0.79
RAB9A P51151 5/20 0.71
NPC1 O15118 4/20 0.71
SMN1; SMN2 Q16637 2/20 0.64
TP53 P04637 1/20 0.62
TSHR P16473 1/20 0.62
NFKB1 P19838 1/20 0.62
NFKB2 Q00653 1/20 0.62
RELA Q04206 1/20 0.62
L3MBTL1 Q9Y468 1/20 0.62
NOX1 Q9Y5S8 1/20 0.62
GAA P10253 1/20 0.59
CYP1A2 P05177 1/20 0.59
CYP3A4 P08684 1/20 0.59
EPHX1 P07099 3/20 0.59

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
SCHEMBL2682054 0.88 KMT2A (1.00) KMT2AMEN1MAPTLMNAHTT
SCHEMBL11476205 0.83 KMT2A (0.81) KMT2AMEN1MAPTLMNAHTT
SCHEMBL10344695 0.83 MEN1 (1.00) KMT2AMEN1MAPTLMNAHTT
SCHEMBL29077780 0.83 MEN1 (0.89) KMT2AMEN1MAPTLMNAHTT
SCHEMBL29556162 0.83 MEN1 (0.89) KMT2AMEN1MAPTLMNAHTT
SCHEMBL29533340 0.83 MEN1 (1.00) KMT2AMEN1MAPTLMNAHTT
SCHEMBL16500681 0.82 KMT2A (0.79) KMT2AMEN1MAPTLMNAHTT
SCHEMBL3076869 0.81 KMT2A (0.79) KMT2AMEN1MAPTLMNAHTT
SCHEMBL11049956 0.81 MEN1 (0.85) KMT2AMEN1MAPTLMNAHTT
SCHEMBL16488795 0.81 MEN1 (0.51) KMT2AMEN1MAPTLMNAHTT

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3381995-B1 OIL-GELLING AGENT UNIV SHIZUOKA NAT UNIV CORP (JP) 2019-10-23 EP disclosed
US-10189835-B2 Derivatives and methods of treating hepatitis B infections NOVIRA THERAPEUTICS, INC. (US) 2019-01-29 US disclosed
US-20180127415-A1 DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS NOVIRA THERAPEUTICS, INC. 2018-05-10 US disclosed
WO-2018045969-A1 COMPOUND FOR ACTIVATING ADENOSINE MONOPHOSPHATE-ACTIVATED PROTEIN KINASE 法玛科技顾问股份有限公司 2018-03-15 WO disclosed
EP-3016950-B1 TRICYCLIC PYRIDO-CARBOXAMIDE DERIVATIVES AS ROCK INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2017-06-07 EP disclosed
US-9663529-B2 Tricyclic pyrido-carboxamide derivatives as rock inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2017-05-30 US disclosed
US-9663529-B2 Tricyclic pyrido-carboxamide derivatives as rock inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2017-05-30 US disclosed
US-20160152627-A1 TRICYCLIC PYRIDO-CARBOXAMIDE DERIVATIVES AS ROCK INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2016-06-02 US disclosed
US-20160152627-A1 TRICYCLIC PYRIDO-CARBOXAMIDE DERIVATIVES AS ROCK INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2016-06-02 US disclosed
US-20080015184-A1 Urea Substituted Imidazopyridines, Imidazoquinolines, and Imidazonaphthyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2008-01-17 US disclosed
US-20080015184-A1 Urea Substituted Imidazopyridines, Imidazoquinolines, and Imidazonaphthyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2008-01-17 US disclosed
US-5661153-A FOR TREATING ALLERGIES, ASTHMA, DERMATITIS, GRAFT REJECTIONS JAPAN ENERGY CORPORATION (JP) 1997-08-26 US disclosed
EP-0700908-A1 1-Arylpyrimidine derivatives and pharmaceutical use thereof JAPAN ENERGY CORPORATION (JP) 1996-03-13 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 (4 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-10189835-B2 Derivatives and methods of treating hepatitis B infections HAVCR2, PYGL, HCCS KMT2A 4148/4885MEN1 4414/4885MAPT 4552/4885
US-20160152627-A1 TRICYCLIC PYRIDO-CARBOXAMIDE DERIVATIVES AS ROCK INHIBITORS MYLK, MYLK2, ROCK1 KMT2A 1131/4885MEN1 803/4885MAPT 184/4885
US-20080015184-A1 Urea Substituted Imidazopyridines, Imidazoquinolines, and Imidazonaphthyridines IL2, EIF2AK2, IL4 KMT2A 2855/4885MEN1 3849/4885MAPT 2738/4885
US-20180127415-A1 DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS HAVCR2, PYGL, HCCS KMT2A 4148/4885MEN1 4414/4885MAPT 4552/4885

“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.