SCHEMBL2233892

SCHEMBL2233892

O=C(O)N1CCN(Cc2ccc(CCCOc3ccc(Cl)nc3)cc2)CC1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.55
MEN1 O00255 2/20 0.55
ATM Q13315 1/20 0.55
FAAH O00519 2/20 0.44
HRH3 Q9Y5N1 2/20 0.43
KDM4E B2RXH2 1/20 0.43
LMNA P02545 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CYP4F2 P78329 4/20 0.43
CYP4A11 Q02928 4/20 0.43
MGLL Q99685 1/20 0.42
ALDH1A1 P00352 1/20 0.42
S1PR5 Q9H228 1/20 0.42

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
SCHEMBL2234295 0.94 KMT2A (0.56) KMT2AMEN1ATMFAAHKDM4E
SCHEMBL2236136 0.83 FAAH (0.55) KMT2AMEN1FAAHHRH3KDM4E
SCHEMBL1977079 0.83 KMT2A (0.77) KMT2AMEN1ATMFAAHHRH3
SCHEMBL2303680 0.82 HRH3 (0.55) KMT2AMEN1FAAHHRH3KDM4E
SCHEMBL2235426 0.82 SMN1; SMN2 (0.56) KMT2AMEN1ATMFAAHHRH3
SCHEMBL2232064 0.82 FAAH (0.44) KMT2AMEN1ATMFAAHHRH3
SCHEMBL2233177 0.82 HRH3 (0.57) KMT2AMEN1FAAHHRH3KDM4E
SCHEMBL2232938 0.82 FAAH (0.47) KMT2AMEN1ATMFAAHHRH3
SCHEMBL13582442 0.81 KMT2A (0.51) KMT2AMEN1ATMFAAHHRH3
SCHEMBL2231603 0.81 KMT2A (0.51) KMT2AMEN1ATMFAAHHRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2528897-B9 DI-SUBSTITUTED PYRIDINE DERIVATIVES AS ANTICANCERS OTSUKA PHARMA CO LTD (JP) 2015-04-22 EP disclosed
EP-2528897-B1 DI-SUBSTITUTED PYRIDINE DERIVATIVES AS ANTICANCERS OTSUKA PHARMA CO LTD (JP) 2014-10-15 EP disclosed
US-8722663-B2 Di-substituted pyridine derivatives as anticancers OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2014-05-13 US disclosed
EP-2528897-A1 DI - SUBSTITUTED PYRIDINE DERIVATIVES AS ANTICANCERS Otsuka Pharmaceutical Co., Ltd. (JP) 2012-12-05 EP disclosed
US-20120283242-A1 DI - SUBSTITUTED PYRIDINE DERIVATIVES AS ANTICANCERS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2012-11-08 US disclosed
WO-2011093524-A9 DI - SUBSTITUTED PYRIDINE DERIVATIVES AS ANTICANCERS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2011-12-01 WO disclosed
WO-2011093524-A1 DI - SUBSTITUTED PYRIDINE DERIVATIVES AS ANTICANCERS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2011-08-04 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 (1 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-20120283242-A1 DI - SUBSTITUTED PYRIDINE DERIVATIVES AS ANTICANCERS TPD52L2, CCNE2, CDK2 KMT2A 686/4885MEN1 2854/4885ATM 3051/4885

“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.