SCHEMBL6401338

SCHEMBL6401338

N#Cc1ccc2cccc(O)c2n1.[LiH]

nearest known ligand 0.96

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SOS2 Q07890 1/20 0.96
SRC P12931 1/20 0.53
METAP2 P50579 2/20 0.52
PLAU P00749 1/20 0.52
NCF1 P14598 1/20 0.52
ALOX12 P18054 3/20 0.50
ALDH1A1 P00352 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C9 P11712 1/20 0.50
HPGD P15428 1/20 0.50
CYP2C19 P33261 1/20 0.50
HIF1A Q16665 1/20 0.50
HSD17B10 Q99714 1/20 0.50
KDM4E B2RXH2 5/20 0.47
KMT2A Q03164 4/20 0.47
PIM1 P11309 1/20 0.46
TSHR P16473 2/20 0.46
MMP2 P08253 1/20 0.46
CHRM1 P11229 1/20 0.46

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
SCHEMBL906658 0.98 SOS2 (1.00) SOS2SRCMETAP2PLAUNCF1
SCHEMBL6431724 0.96 SOS2 (0.96) SOS2SRCMETAP2PLAUNCF1
SCHEMBL2516025 0.82 SOS2 (0.72) SOS2METAP2PLAUNCF1ALOX12
SCHEMBL5346454 0.77 SOS2 (0.63) SOS2SRCCTSBRAB9A
SCHEMBL10649714 0.76 SOS2 (0.64) SOS2METAP2PLAUNCF1ALOX12
SCHEMBL13977559 0.76 SOS2 (0.62) SOS2SRCPLAUCYP3A4HIF1A
SCHEMBL30824469 0.76 SOS2 (0.62) SOS2SRCALDH1A1HPGDKDM4E
SCHEMBL11036934 0.76 SOS2 (0.62) SOS2SRCALDH1A1HSD17B10KDM4E
SCHEMBL4771863 0.76 SOS2 (0.62) SOS2SRCCYP1A2CTSBLMNA
SCHEMBL3578542 0.76 SOS2 (0.62) SOS2SRCPLAUNCF1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6921589-B2 Electroluminescent elements TORAY INDUSTRIES, INC. (JP) 2005-07-26 US disclosed
US-20020160227-A1 Electroluminescent elements KOHAMA AKIRA (JP) 2002-10-31 US disclosed
EP-1000998-B1 Electroluminescent element and devices TORAY INDUSTRIES (JP) 2002-10-09 EP disclosed
EP-1000998-A1 Electroluminescent element and devices TORAY INDUSTRIES, INC. (JP) 2000-05-17 EP disclosed