SCHEMBL1060980

SCHEMBL1060980

N#Cc1ccc(OCc2ccccc2)c(F)c1

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.58
MRGPRX4 Q96LA9 8/20 0.49
SLC6A9 P48067 1/20 0.48
SLK Q9H2G2 2/20 0.47
STK10 O94804 1/20 0.47
PTGER1 P34995 1/20 0.46
S1PR5 Q9H228 1/20 0.45
GABRG2 P18507 1/20 0.44
GABRB3 P28472 1/20 0.44
GABRA5 P31644 1/20 0.44
GABRA3 P34903 1/20 0.44
ALDH1A1 P00352 1/20 0.44
PPIA P62937 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
SCHEMBL9195885 0.88 MAOB (0.56) MAOBMRGPRX4SLKSTK10PTGER1
SCHEMBL20302267 0.88 MAOB (0.58) MAOBMRGPRX4SLC6A9PTGER1GABRG2
SCHEMBL224350 0.84 S1PR5 (0.48) MAOBMRGPRX4PTGER1S1PR5
SCHEMBL23235823 0.83 MCL1 (0.49) MAOBALDH1A1
SCHEMBL1330628 0.83 MAOB (0.62) MAOBMRGPRX4
SCHEMBL23541002 0.82 MRGPRX4 (0.44) MAOBMRGPRX4SLC6A9SLKSTK10
SCHEMBL15588793 0.81 MAOB (0.46) MAOBMRGPRX4S1PR5ALDH1A1
SCHEMBL1980141 0.81 MAOB (0.58) MAOBMRGPRX4PTGER1GABRG2GABRB3
SCHEMBL214965 0.81 MAOB (0.58) MAOBMRGPRX4PTGER1GABRG2GABRB3
SCHEMBL7129137 0.81 MAOB (0.58) MAOBMRGPRX4PTGER1GABRG2GABRB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118307534-A LTA4H inhibitors and uses thereof 上海海雁医药科技有限公司 2024-07-09 CN disclosed
WO-2023029380-A1 NOVEL ARYL ETHER SUBSTITUTED HETEROCYCLIC COMPOUND AS GLP1R AGONIST 杭州德睿智药科技有限公司 2023-03-09 WO disclosed
US-11161805-B2 Process for the transition metal catalyzed cyanation of aryl/vinyl halides STUDIENGESELLSCHAFT KOHLE MBH (DE) 2021-11-02 US disclosed
EP-3691784-B1 PROCESS FOR THE TRANSITION METAL CATALYZED CYANATION OF ARYL/VINYL HALIDES STUDIENGESELLSCHAFT KOHLE MBH (DE) 2021-09-08 EP disclosed
US-20200325099-A1 PROCESS FOR THE TRANSITION METAL CATALYZED CYANATION OF ARYL/VINYL HALIDES STUDIENGESELLSCHAFT KOHLE MBH (DE) 2020-10-15 US disclosed
CN-102459222-B L- (piperidin-4-yl) -pyrazole derivatives as GPR119 modulators PFIZER 2014-06-04 CN disclosed
EP-2643310-A1 4- (5-CYANO-PYRAZOL-1-YL) -PIPERIDINE DERIVATIVES AS GPR 119 MODULATORS Pfizer Inc (US) 2013-10-02 EP disclosed
CN-103298801-A 4- (5-cyano-pyrazol-1-yl) -piperidine derivatives as GPR 119 modulators PFIZER 2013-09-11 CN disclosed
WO-2012069948-A1 4- (5-CYANO-PYRAZOL-1-YL) -PIPERIDINE DERIVATIVES AS GPR 119 MODULATORS PFIZER INC. (US) 2012-05-31 WO disclosed
CN-102459222-A L- (piperidin-4-yl) -pyrazole derivatives as GPR119 modulators PFIZER 2012-05-16 CN disclosed
EP-2438051-A1 L- ( PIPERIDIN-4-YL) -PYRAZOLE DERIVATIVES AS GPR 119 MODULATORS Pfizer Inc. (US) 2012-04-11 EP disclosed
EP-2395835-A1 AGONISTS AND ANTAGONISTS OF THE SIP5 RECEPTOR, AND METHODS OF USES THEREOF Abbott Laboratories (US) 2011-12-21 EP disclosed
US-20110020460-A1 GPR 119 MODULATORS PFIZER INC. 2011-01-27 US disclosed
WO-2010140092-A1 L- ( PIPERIDIN-4-YL) -PYRAZOLE DERIVATIVES AS GPR 119 MODULATORS PFIZER INC. (US) 2010-12-09 WO disclosed
US-20100216762-A1 Agonists and Antagonists of the S1P5 Receptor, and Methods of Use Thereof ABBOTT LABORATORIES (US) 2010-08-26 US disclosed
US-20100216762-A1 Agonists and Antagonists of the S1P5 Receptor, and Methods of Use Thereof ABBOTT LABORATORIES (US) 2010-08-26 US disclosed
US-20100216762-A1 Agonists and Antagonists of the S1P5 Receptor, and Methods of Use Thereof ABBOTT LABORATORIES (US) 2010-08-26 US disclosed
WO-2010093704-A1 AGONISTS AND ANTAGONISTS OF THE S1P5 RECEPTOR, AND METHODS OF USES THEREOF ABBOTT LABORATORIES (US) 2010-08-19 WO disclosed
WO-2010093704-A1 AGONISTS AND ANTAGONISTS OF THE S1P5 RECEPTOR, AND METHODS OF USES THEREOF ABBOTT LABORATORIES (US) 2010-08-19 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 (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-20200325099-A1 PROCESS FOR THE TRANSITION METAL CATALYZED CYANATION OF ARYL/VINYL HALIDES CYP3A4, CRBN, POR MAOB 1748/4885MRGPRX4 4463/4885SLC6A9 884/4885
US-20100216762-A1 Agonists and Antagonists of the S1P5 Receptor, and Methods of Use Thereof S1PR5, LPAR5, S1PR1 MAOB 2578/4885MRGPRX4 228/4885SLC6A9 4515/4885
US-20110020460-A1 GPR 119 MODULATORS GPR119, GPR65, GPR88 MAOB 1966/4885MRGPRX4 57/4885SLC6A9 1819/4885
US-11161805-B2 Process for the transition metal catalyzed cyanation of aryl/vinyl halides CYP3A4, CRBN, POR MAOB 1748/4885MRGPRX4 4463/4885SLC6A9 884/4885

“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.