SCHEMBL2235689

SCHEMBL2235689

O=C(O)N1CCN(Cc2ccc(-c3ccccc3)cc2)CC1

nearest known ligand 0.69

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.69
HRH3 Q9Y5N1 2/20 0.66
MGLL Q99685 1/20 0.59
ALDH1A1 P00352 4/20 0.58
LMNA P02545 2/20 0.58
KMT2A Q03164 2/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
KDM4E B2RXH2 1/20 0.56
CHKA P35790 1/20 0.56
TSHR P16473 2/20 0.55
MEN1 O00255 1/20 0.55
MAPK1 P28482 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
SIGMAR1 Q99720 1/20 0.55

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
SCHEMBL2850013 0.90 ALDH1A1 (0.70) FAAHMGLLALDH1A1LMNAKMT2A
SCHEMBL5543569 0.87 FAAH (0.66) FAAHHRH3MGLLALDH1A1LMNA
SCHEMBL5543578 0.87 HRH3 (0.88) FAAHHRH3MGLLALDH1A1LMNA
SCHEMBL5542086 0.84 FAAH (0.63) FAAHHRH3MGLLALDH1A1LMNA
SCHEMBL5484678 0.84 MEN1 (0.61) FAAHHRH3KMT2ASMN1; SMN2TSHR
SCHEMBL16226080 0.84 SIGMAR1 (0.78) FAAHHRH3ALDH1A1LMNAKMT2A
SCHEMBL26623128 0.83 FAAH (0.61) FAAHHRH3MGLLALDH1A1KMT2A
SCHEMBL2931705 0.83 AKR1C3 (0.65) FAAHHRH3MGLLALDH1A1LMNA
SCHEMBL31277423 0.83 HRH3 (0.56) FAAHHRH3ALDH1A1LMNAKMT2A
SCHEMBL22346647 0.83 HRH3 (0.56) FAAHHRH3ALDH1A1LMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1836179-B1 PIPERIDINE- AND PIPERAZINE-1-CARBOXYLIC ACID AMIDE DERIVATIVES AND RELATED COMPOUNDS AS MODULATORS OF FATTY ACID AMIDE HYDROLASE (FAAH) FOR THE TREATMENT OF ANXIETY, PAIN AND OTHER CONDITIONS JANSSEN PHARMACEUTICA NV (BE) 2015-05-06 EP disclosed
EP-2528897-B9 DI-SUBSTITUTED PYRIDINE DERIVATIVES AS ANTICANCERS OTSUKA PHARMA CO LTD (JP) 2015-04-22 EP disclosed
US-8894970-B2 Arginase inhibitors and methods of use thereof CORRIDOR PHARMACEUTICALS, INC. (US) 2014-11-25 US 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
US-20120171116-A1 Arginase Inhibitors and Methods of Use Thereof CORRIDOR PHARMACEUTICALS, INC. 2012-07-05 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 (2 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-20120171116-A1 Arginase Inhibitors and Methods of Use Thereof ARG1, ARG2, PRMT1 FAAH 934/4885HRH3 263/4885MGLL 1400/4885
US-20120283242-A1 DI - SUBSTITUTED PYRIDINE DERIVATIVES AS ANTICANCERS TPD52L2, CCNE2, CDK2 FAAH 4663/4885HRH3 663/4885MGLL 3799/4885

“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.