SCHEMBL7633786

SCHEMBL7633786

C=CC(=O)OCCNc1ccc(Nc2ccccc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.51
MAPT P10636 8/20 0.42
ALDH1A1 P00352 7/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
PTPN7 P35236 1/20 0.42
PTPN12 Q05209 1/20 0.42
CASP3 P42574 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
HDAC3 O15379 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
ALOX12 P18054 2/20 0.40
MAPK1 P28482 2/20 0.40
TGM2 P21980 1/20 0.40
MAPK13 O15264 1/20 0.40
MAPK12 P53778 1/20 0.40
MAPK11 Q15759 1/20 0.40

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
SCHEMBL988048 0.94 THRB (0.57) THRBMAPTALDH1A1MEN1KMT2A
SCHEMBL30098565 0.85 THRB (0.54) THRBMAPTALDH1A1MEN1KMT2A
SCHEMBL22648161 0.82 MAPT (0.48) THRBMAPTALDH1A1KMT2ATGM2
SCHEMBL16039243 0.81 HCAR2 (0.51) THRBMAPTALDH1A1MEN1KMT2A
SCHEMBL20615035 0.80 SMN1; SMN2 (0.54) THRBMAPTALDH1A1MEN1KMT2A
Hydrochloric Acid SCHEMBL16039293 0.80 HCAR2 (0.50) THRBMAPTALDH1A1MEN1KMT2A
SCHEMBL23409891 0.79 TSHR (0.44) THRBMAPTALDH1A1MEN1KMT2A
SCHEMBL529822 0.79 THRB (0.37) THRBMAPTALDH1A1MEN1KMT2A
SCHEMBL27214690 0.79 THRB (0.48) THRBMAPTALDH1A1MEN1KMT2A
SCHEMBL10627202 0.79 THRB (0.43) THRBMAPTALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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