SCHEMBL7643452

SCHEMBL7643452

Cc1sc2ccccc2c1C1=C(c2c(C)sc3cc(C(=O)O)ccc23)C(F)(F)C(F)(F)C1(F)F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLA2G10 O15496 1/20 0.39
▸ POLB P06746 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ KDM4E B2RXH2 3/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ LMNA P02545 1/20 0.35
▸ NFKB1 P19838 1/20 0.35
▸ NFKB2 Q00653 1/20 0.35
▸ RELA Q04206 1/20 0.35
▸ TBXAS1 P24557 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ PRNP P04156 1/20 0.34
▸ RXFP1 Q9HBX9 1/20 0.34
▸ MAOB P27338 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ ACLY P53396 1/20 0.34
▸ MCL1 Q07820 1/20 0.33
▸ PARP1 P09874 1/20 0.33
▸ TTR P02766 1/20 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
SCHEMBL5087788 0.94 SMN1; SMN2 (0.38) KDM4ESMN1; SMN2LMNANFKB1NFKB2
SCHEMBL6487227 0.91 PLA2G10 (0.39) PLA2G10MAPTNPC1RAB9ARXFP1
SCHEMBL7104988 0.87 CYP1A2 (0.37) PLA2G10MAPTKDM4ESMN1; SMN2LMNA
SCHEMBL5688195 0.84 CA2 (0.35) PLA2G10MAPTKDM4ESMN1; SMN2NPC1
SCHEMBL29492999 0.83 GPR3 (0.39) PLA2G10MAPTKDM4ESMN1; SMN2LMNA
SCHEMBL392860 0.83 GPR3 (0.39) PLA2G10MAPTKDM4ESMN1; SMN2LMNA
SCHEMBL6850965 0.83 MAOB (0.34) PLA2G10MAOBCNR1CNR2
SCHEMBL7645370 0.81 PLA2G10 (0.33) PLA2G10
SCHEMBL6498933 0.80 PLA2G10 (0.37) PLA2G10MAPTSMN1; SMN2RAB9AALDH1A1
SCHEMBL7648773 0.79 PLA2G10 (0.32) PLA2G10MAPTRXFP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6479604-B1 Diarylethene compound, photochromic diarylethene type copolymer and method for the production of the same KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2002-11-12 — — US disclosed
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