SCHEMBL14383620

SCHEMBL14383620

CC(=NN=C(S)Cc1ccc(C(F)(F)F)cc1)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 2/20 0.40
▸ PPARA Q07869 2/20 0.40
▸ GRIN2B Q13224 2/20 0.40
▸ PDPK1 O15530 1/20 0.39
▸ MAOB P27338 2/20 0.38
▸ CNR2 P34972 1/20 0.37
▸ RAB9A P51151 2/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ HSD11B1 P28845 1/20 0.36
▸ RXRA P19793 1/20 0.36
▸ RXRB P28702 1/20 0.36
▸ RXRG P48443 1/20 0.36
▸ GRIN1 Q05586 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ LTA4H P09960 1/20 0.36
▸ EPHX2 P34913 1/20 0.36
▸ KCNH2 Q12809 1/20 0.36
▸ SRD5A2 P31213 1/20 0.35
▸ MAPK14 Q16539 1/20 0.35

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
SCHEMBL17627132 0.76 CYP1A2 (0.51) PPARGPPARAGRIN2BMAOBRAB9A
SCHEMBL17686769 0.76 CYP1A2 (0.51) PPARGPPARAGRIN2BMAOBRAB9A
SCHEMBL1040696 0.69 PIK3CA (0.55) PDPK1CNR2RAB9ANPC1HSD11B1
SCHEMBL7968589 0.69 FURIN (0.56) RAB9ANPC1MEN1KMT2AALDH1A1
SCHEMBL4037961 0.69 FURIN (0.56) RAB9ANPC1MEN1KMT2AALDH1A1
SCHEMBL4279968 0.69 FURIN (0.56) RAB9ANPC1MEN1KMT2AALDH1A1
Trifluoromethylbenzene SCHEMBL28068069 0.69 ALDH1A1 (0.54) PPARGPPARAGRIN2BRAB9ANPC1
SCHEMBL5161111 0.69 CNR2 (0.58) PPARGPPARAPDPK1CNR2RXRA
SCHEMBL27453647 0.68 FURIN (0.46) RAB9ANPC1MEN1KMT2AALDH1A1
SCHEMBL9481888 0.68 TAAR1 (0.48) MAOBRXRARXRBRXRGSRD5A2

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
EP-1708025-B1 Photosensitive lithographic printing plate FUJIFILM CORP (JP) 2007-11-07 — — EP disclosed
EP-1829681-A2 Method for preparation of lithographic printing plate and lithographic printing plate precursor FUJIFILM Corporation (JP) 2007-09-05 — — EP disclosed
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