SCHEMBL171946

SCHEMBL171946

CCN(C)Cc1ccc(F)cc1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PYCR1 P32322 2/20 0.60
ALDH1A1 P00352 2/20 0.50
TAAR1 Q96RJ0 1/20 0.48
RIPK1 Q13546 2/20 0.47
CHRNB2 P17787 1/20 0.47
CHRNA4 P43681 1/20 0.47
AOC3 Q16853 1/20 0.45
KDM4E B2RXH2 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
NPC1 O15118 1/20 0.43
CXCR3 P49682 1/20 0.43
RAB9A P51151 1/20 0.43
ESR1 P03372 1/20 0.42
ESR2 Q92731 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
Hydrochloric Acid SCHEMBL27258921 0.98 PYCR1 (0.58) PYCR1ALDH1A1TAAR1RIPK1CHRNB2
SCHEMBL3191532 0.88 PYCR1 (0.67) PYCR1ALDH1A1TAAR1RIPK1AOC3
SCHEMBL12763726 0.88 CHRNB2 (0.56) PYCR1ALDH1A1CHRNB2CHRNA4KDM4E
SCHEMBL15308539 0.83 PYCR1 (0.56) PYCR1ALDH1A1TAAR1RIPK1AOC3
SCHEMBL22304838 0.82 PYCR1 (0.60) PYCR1ALDH1A1TAAR1RIPK1AOC3
SCHEMBL12910454 0.81 CHRNB2 (0.50) PYCR1ALDH1A1TAAR1CHRNB2CHRNA4
SCHEMBL3339451 0.80 PYCR1 (0.58) PYCR1ALDH1A1TAAR1RIPK1AOC3
SCHEMBL21268450 0.80 ALDH1A1 (0.63) PYCR1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL13232509 0.80 PYCR1 (0.58) PYCR1ALDH1A1TAAR1AOC3KDM4E
SCHEMBL21664511 0.79 PYCR1 (0.53) PYCR1ALDH1A1TAAR1RIPK1AOC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11548870-B2 Compounds useful as inhibitors of helios protein BRISTOL-MYERS SQUIBB COMPANY (US) 2023-01-10 US disclosed
WO-2021101919-A1 COMPOUNDS USEFUL AS INHIBITORS OF HELIOS PROTEIN BRISTOL-MYERS SQUIBB COMPANY (US) 2021-05-27 WO disclosed
US-20210147383-A1 COMPOUNDS USEFUL AS INHIBITORS OF HELIOS PROTEIN BRISTOL-MYERS SQUIBB COMPANY 2021-05-20 US disclosed
EP-3110810-B1 PYRAZOLE AMIDE DERIVATIVE TEIJIN PHARMA LTD (JP) 2018-05-02 EP disclosed
US-9708305-B2 Substituted 1,2,3,4-tetrahydroisoquinoline derivatives for the treatment of hormone-dependent diseases UNIVERSITé LAVAL (CA) 2017-07-18 US disclosed
US-9708305-B2 Substituted 1,2,3,4-tetrahydroisoquinoline derivatives for the treatment of hormone-dependent diseases UNIVERSITé LAVAL (CA) 2017-07-18 US disclosed
US-20160200685-A1 SUBSTITUTED 1,2,3,4-TETRAHYDROISOQUINOLINE DERIVATIVES FOR THE TREATMENT OF HORMONE-DEPENDENT DISEASES UNIVERSITé LAVAL (CA) 2016-07-14 US disclosed
US-20160200685-A1 SUBSTITUTED 1,2,3,4-TETRAHYDROISOQUINOLINE DERIVATIVES FOR THE TREATMENT OF HORMONE-DEPENDENT DISEASES UNIVERSITé LAVAL (CA) 2016-07-14 US disclosed
US-9266834-B2 1, 4-disubstituted 3-cyano-pyridone derivatives and their use as positive allosteric modulators of MGLUR2-receptors Janssen Pharmaceuticals, Inc. (US) 2016-02-23 US disclosed
US-9266834-B2 1, 4-disubstituted 3-cyano-pyridone derivatives and their use as positive allosteric modulators of MGLUR2-receptors Janssen Pharmaceuticals, Inc. (US) 2016-02-23 US disclosed
US-20110281837-A1 3-SUBSTITUTED-6-ARYL PYRIDINES HUTCHINSON ALAN J (US) 2011-11-17 US disclosed
US-7863454-B2 3-substituted-6-aryl pyridines NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2011-01-04 US disclosed
US-20100166655-A1 1, 4-DISUBSTITUTED 3-CYANO-PYRIDONE DERIVATIVES AND THEIR USE AS POSITIVE ALLOSTERIC MODULATORS OF MGLUR2-RECEPTORS JANSSEN PHARMACEUTICA N.V. (BE) 2010-07-01 US disclosed
US-20090176980-A1 3-Substituted-6-Aryl Pyridines NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2009-07-09 US disclosed
US-7342115-B2 Binding antagonist and arylpyridine for antiinflammatory agents, cardiovascular disorders and antagonist or agonist and for immunology NEUROGEN CORPORATION (US) 2008-03-11 US disclosed
WO-2007104783-A2 1,4 -DI SUBSTITUTED 3-CYANO-PYRIDONE DERIVATIVES AND THEIR USE AS POSITIVE MGLUR2-RECEPT0R MODULATORS ORTHO-MCNEIL-JANSSEN PHARMACEUTICALS, INC. (US) 2007-09-20 WO disclosed
CN-1014393-B Preparing a new formulation CHINOIN GYOGYSZTER ES VEGYESZE (HU) 1991-10-23 CN disclosed
CN-1010307-B Process for preparing N- [2- (4-fluorophenyl) -1-methyl ] -ethyl-N-methyl-N-propargylamine and isomers or salts thereof CHINOIN GYOGYSZER ES VEGYESZET (HU) 1990-11-07 CN disclosed
CN-1044399-A Prepare a kind of new preparation CHINOIN GYOGYSZTER ES VEGYESZE (HU) 1990-08-08 CN disclosed
CN-85104166-A Preparation of new medicine and its preparation 1986-11-26 CN 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 (6 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-20110281837-A1 3-SUBSTITUTED-6-ARYL PYRIDINES C3AR1, C5AR1, C5AR2 PYCR1 786/4885ALDH1A1 1966/4885TAAR1 134/4885
US-20090176980-A1 3-Substituted-6-Aryl Pyridines C3AR1, C5AR1, C5AR2 PYCR1 786/4885ALDH1A1 1966/4885TAAR1 134/4885
US-20210147383-A1 COMPOUNDS USEFUL AS INHIBITORS OF HELIOS PROTEIN IKZF2, RPL6, HNRNPR PYCR1 3928/4885ALDH1A1 3947/4885TAAR1 3854/4885
US-20100166655-A1 1, 4-DISUBSTITUTED 3-CYANO-PYRIDONE DERIVATIVES AND THEIR USE AS POSITIVE ALLOSTERIC MODULATORS OF MGLUR2-RECEPTORS GRM2, GRM1, GRM3 PYCR1 644/4885ALDH1A1 2815/4885TAAR1 309/4885
US-20160200685-A1 SUBSTITUTED 1,2,3,4-TETRAHYDROISOQUINOLINE DERIVATIVES FOR THE TREATMENT OF HORMONE-DEPENDENT DISEASES STS, SHBG, CYP19A1 PYCR1 1380/4885ALDH1A1 1010/4885TAAR1 974/4885
US-11548870-B2 Compounds useful as inhibitors of helios protein IKZF2, RPL6, HNRNPR PYCR1 3928/4885ALDH1A1 3947/4885TAAR1 3854/4885

“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.