SCHEMBL7639474

SCHEMBL7639474

C=C(C)C(=O)OC(Nc1ccc(Nc2ccccc2)cc1)C(C)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.45
ALOX12 P18054 3/20 0.45
LMNA P02545 2/20 0.45
CYP3A4 P08684 2/20 0.45
ALOX15 P16050 2/20 0.45
TSHR P16473 2/20 0.45
HSD17B10 Q99714 2/20 0.45
THRB P10828 1/20 0.45
RECQL P46063 1/20 0.45
ATM Q13315 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
HPGD P15428 5/20 0.43
MAPT P10636 11/20 0.43
GAA P10253 5/20 0.43
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
RXFP1 Q9HBX9 2/20 0.43
HSP90AA1 P07900 1/20 0.43
POLB P06746 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
SCHEMBL10484020 0.81 ALDH1A1 (0.45) ALDH1A1ALOX12LMNACYP3A4ALOX15
SCHEMBL305727 0.78 ALDH1A1 (0.45) ALDH1A1ALOX12LMNACYP3A4ALOX15
SCHEMBL29210266 0.77 ALDH1A1 (0.44) ALDH1A1ALOX12LMNACYP3A4ALOX15
SCHEMBL11650812 0.77 ALDH1A1 (0.41) ALDH1A1ALOX12LMNACYP3A4ALOX15
SCHEMBL7639467 0.77 ALDH1A1 (0.46) ALDH1A1ALOX12LMNACYP3A4ALOX15
SCHEMBL11653130 0.75 HPGD (0.41) ALDH1A1ALOX12LMNACYP3A4ALOX15
SCHEMBL7951993 0.75 MAPT (0.42) ALDH1A1ALOX12LMNACYP3A4ALOX15
SCHEMBL7952001 0.74 MAPT (0.41) ALDH1A1ALOX12LMNAHPGDMAPT
SCHEMBL28334967 0.73 ALDH1A1 (0.47) ALDH1A1ALOX12LMNACYP3A4ALOX15
SCHEMBL6558610 0.72 MAPT (0.70) ALDH1A1ALOX12ALOX15TSHRHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4871794-A (METH)ACRYLOYL-P-PHENYLENEDIAMINE DERIVATIVES; GRIPPING, HEAT RESISTANCE BRIDGESTONE CORPORATION (JP) 1989-10-03 US claimed
CN-112080143-A Nylon reinforced material and preparation method thereof 上海盈固化工有限公司 2020-12-15 CN disclosed
US-6388015-B1 BLEND OF NITRILE AND ALKYL ACRYLATE COPOLYMER WITH ETHYLENE-OCTENE COPOLYMER NIPPON ZEON CO., LTD. (JP) 2002-05-14 US disclosed
EP-1008624-A1 RUBBER COMPOSITION, ELECTRIC WIRE COATING MATERIAL, AND ELECTRIC WIRE Nippon Zeon Co., Ltd. (JP) 2000-06-14 EP disclosed
US-5225479-A Wear resistance, wet traction THE GOODYEAR TIRE & RUBBER COMPANY (US) 1993-07-06 US disclosed
US-4871794-A (METH)ACRYLOYL-P-PHENYLENEDIAMINE DERIVATIVES; GRIPPING, HEAT RESISTANCE BRIDGESTONE CORPORATION (JP) 1989-10-03 US disclosed