SCHEMBL9357896

SCHEMBL9357896

C=CC(N)Sc1ccccc1N

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.46
▸ MAPT P10636 5/20 0.46
▸ MEN1 O00255 4/20 0.46
▸ NPSR1 Q6W5P4 4/20 0.46
▸ APOBEC3G Q9HC16 2/20 0.46
▸ MAP2K1 Q02750 3/20 0.44
▸ POLB P06746 1/20 0.38
▸ TDP1 Q9NUW8 3/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ MAPK1 P28482 2/20 0.38
▸ CYP3A4 P08684 2/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ SMN1; SMN2 Q16637 3/20 0.35
▸ ALOX15 P16050 2/20 0.35
▸ CASP1 P29466 1/20 0.35
▸ CASP7 P55210 1/20 0.35
▸ ALDH1A1 P00352 4/20 0.33
▸ LMNA P02545 2/20 0.33

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
SCHEMBL9753187 0.78 MAPT (0.45) KMT2AMAPTMEN1NPSR1APOBEC3G
SCHEMBL999078 0.74 MAPT (0.54) KMT2AMAPTMEN1NPSR1APOBEC3G
SCHEMBL7581178 0.72 MAOA (0.38) MAPTMAPK1CYP3A4CYP1A2CYP2C9
SCHEMBL9018894 0.70 MAPT (0.54) KMT2AMAPTMEN1NPSR1APOBEC3G
SCHEMBL1014289 0.70 MAPT (0.54) KMT2AMAPTMEN1NPSR1APOBEC3G
SCHEMBL540557 0.70 MAPT (0.54) KMT2AMAPTMEN1NPSR1APOBEC3G
SCHEMBL8263320 0.70 MEN1 (0.56) KMT2AMAPTMEN1NPSR1APOBEC3G
SCHEMBL11375178 0.69 MAPT (0.48) KMT2AMAPTMEN1NPSR1APOBEC3G
Hydrochloric Acid SCHEMBL19896479 0.68 MAPT (0.52) KMT2AMAPTMEN1NPSR1APOBEC3G
SCHEMBL1082915 0.67 MEN1 (0.69) KMT2AMAPTMEN1NPSR1APOBEC3G

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8530626-B1 Methods to produce keratin elastomer THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 2013-09-10 — — US disclosed
EP-0617710-A1 ISOCYANATE-TRIMERIZATION CATALYST BAYER AG (DE) 1994-10-05 — — EP disclosed
EP-0292772-B1 Polyether-polycarbonate diols, their preparation and their use as starting products for polyurethanes BAYER AG (DE) 1993-12-08 — — EP disclosed
WO-1993012153-A1 ISOCYANATE-TRIMERIZATION CATALYST BAYER AKTIENGESELLSCHAFT (DE) 1993-06-24 — — WO disclosed
US-5099058-A N, N-disubstituted oligourethanes and polyurethanes, a process for their preparation, and their use in the production of plastics BAYER AKTIENGESELLSCHAFT, LEVERKUSEN, GERMANY, A CORP. OF GERMANY 1992-03-24 — — US disclosed
EP-0217247-B1 PROCESS FOR THE PREPARATION OF POLYAMINES, POLYAMINES AND THEIR USE IN THE PREPARATION OF POLYURETHANES BAYER AG (DE) 1991-03-13 — — EP disclosed
US-4931595-A Catalytic hydrolysis process for polyamines BAYER AKTIENGESELLSCHAFT (DE) 1990-06-05 — — US disclosed
EP-0351640-A1 N,N-disubstituted oligo- and polyurethanes, process for their preparation and their use in preparing plastics BAYER AG (DE) 1990-01-24 — — EP disclosed
EP-0121850-B1 PROCESS FOR PREPARING A CELLULAR POLYURETHANE BAYER AG (DE) 1989-08-30 — — EP disclosed
EP-0171019-B1 PROCESS FOR THE PREPARATION OF IF NEED BE CELLULAR POLYURETHANES BAYER AG (DE) 1989-08-16 — — EP disclosed
EP-0008444-A2 Process for preparing modified polyether polyols and their use for preparing polyurethane plastics BAYER AG (DE) 1980-03-05 — — EP disclosed
EP-0008044-A1 A process for the production of filler suspensions in polyols, stabilized against separation, and their use in a process for the production of polyurethanes that may be cellular BAYER AG (DE) 1980-02-20 — — EP disclosed
EP-0007440-A1 Hexahydrotriazine carboxylates, their preparation and their use as catalysts in the production of polyisocyanurate plastics BAYER AG (DE) 1980-02-06 — — EP disclosed
EP-0007100-A2 Process for preparing low molecular weight polyhydroxylic compounds and their use BAYER AG (DE) 1980-01-23 — — EP disclosed
EP-0007102-A2 Process for preparing low molecular weight polyhydroxylic compounds and their use BAYER AG (DE) 1980-01-23 — — EP disclosed
EP-0007050-A1 Process for preparing polyisocyanurate resins as well as phosphonate salts BAYER AG (DE) 1980-01-23 — — EP disclosed
EP-0007052-A1 Ammonium salts of alpha-ketocarboxylic acids, their use for the preparation of amines and coating materials containing them BAYER AG (DE) 1980-01-23 — — EP disclosed
EP-0006174-A1 Process for the preparation of coatings from polyurethane-urea elastomers BAYER AG (DE) 1980-01-09 — — EP disclosed
EP-0005549-A2 Process for manufacturing textiles coated with polyurethane foam Mobay Chemical Corporation (US) 1979-11-28 — — EP disclosed
EP-0000551-A1 Polyurethane resins containing thio groups and process for their preparation BAYER AG (DE) 1979-02-07 — — EP disclosed
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