SCHEMBL8715209

SCHEMBL8715209

Cc1cccc(-c2c[nH]c(-c3c(C)n[nH]c3C)n2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHEK1 O14757 1/20 0.47
▸ AKT2 P31751 1/20 0.47
▸ IDO1 P14902 1/20 0.43
▸ METAP2 P50579 1/20 0.43
▸ XDH P47989 1/20 0.39
▸ TP53 P04637 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ CYP2C9 P11712 2/20 0.38
▸ PIN1 Q13526 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ NOTUM Q6P988 1/20 0.38
▸ MAPK1 P28482 1/20 0.37
▸ IKBKE Q14164 1/20 0.37
▸ IKBKB O14920 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ GRK6 P43250 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ NPC1 O15118 1/20 0.36

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
SCHEMBL13035810 0.80 AKT2 (0.67) CHEK1AKT2IDO1METAP2CYP2C9
SCHEMBL15029191 0.77 IDO1 (0.47) IDO1METAP2XDHPIN1MAPK1
SCHEMBL26467067 0.74 ACHE (0.48) IDO1METAP2XDHTP53MAPT
SCHEMBL31659868 0.74 ACHE (0.48) IDO1METAP2XDHTP53MAPT
SCHEMBL17280168 0.73 IDO1 (0.36) IDO1METAP2XDHTP53MAPT
SCHEMBL10604269 0.72 IDO1 (0.51) IDO1METAP2XDHCYP2C9CYP1A2
SCHEMBL17231794 0.71 RAB9A (0.49) IDO1METAP2XDHTP53MAPT
SCHEMBL29662878 0.71 MAPK14 (0.53) IDO1METAP2XDHCYP2C9PIN1
SCHEMBL29662867 0.71 MAPK14 (0.56) —
SCHEMBL26464210 0.70 PBRM1 (0.44) IDO1METAP2XDHPIN1KDM4E

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
JP-9263581-A — — None — — JP disclosed
US-5814580-A FORMING A CHELATE DYE BY THE REACTION OF AN AZOMETHINE DYE WITH A METAL-ION CONTAINING COMPOUND; EXCELLENT LIGHT FASTNESS KONICA CORPORATION (JP) 1998-09-29 — — US disclosed
JP-H09263581-A NEW PHOTOSENSITIVE PIGMENT KONIKA CHEM:KK 1997-10-07 — — JP disclosed
EP-0732220-A1 Thermal transfer recording material KONICA CORPORATION (JP) 1996-09-18 — — EP disclosed
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