SCHEMBL7688894

SCHEMBL7688894

CC1CCCCN1CCCNc1ncc2nc(-c3ccccc3)c(=O)[nH]c2n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC2A1 P11166 2/20 0.50
▸ MEN1 O00255 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ POLB P06746 1/20 0.46
▸ CSNK2A1 P68400 1/20 0.43
▸ FGFR1 P11362 1/20 0.43
▸ ALDH1A1 P00352 6/20 0.42
▸ HSD17B10 Q99714 5/20 0.42
▸ HPGD P15428 4/20 0.42
▸ KDM4E B2RXH2 3/20 0.42
▸ CYP3A4 P08684 3/20 0.42
▸ TSHR P16473 2/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ DRD2 P14416 2/20 0.41
▸ HTR2A P28223 2/20 0.41
▸ HTR2C P28335 2/20 0.41
▸ CYP1A2 P05177 2/20 0.41
▸ CASP1 P29466 2/20 0.41
▸ CASP7 P55210 2/20 0.41
▸ CYP2D6 P10635 1/20 0.41

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
SCHEMBL7695534 0.85 ACP1 (0.45) MEN1KMT2AALDH1A1HSD17B10CYP1A2
SCHEMBL7694476 0.81 ALDH1A1 (0.45) MEN1KMT2AALDH1A1HSD17B10HPGD
SCHEMBL7688448 0.80 MKNK1 (0.51) ALDH1A1HSD17B10HPGDKDM4ELMNA
SCHEMBL7695066 0.79 MERTK (0.51) MEN1KMT2APOLBCSNK2A1FGFR1
SCHEMBL7690773 0.76 HSD17B10 (0.43) ALDH1A1HSD17B10HPGDKDM4ECYP3A4
SCHEMBL7695125 0.75 KDM4E (0.51) MEN1KMT2AHSD17B10KDM4ETSHR
SCHEMBL7696545 0.75 TSHR (0.45) SLC2A1POLBFGFR1ALDH1A1HSD17B10
SCHEMBL7696148 0.74 CACNA2D1 (0.46) MEN1KMT2APOLBFGFR1ALDH1A1
SCHEMBL1184442 0.72 KDR (0.52) SLC2A1MEN1KMT2AFGFR1
SCHEMBL7695093 0.72 CYP1A2 (0.46) MEN1KMT2ACSNK2A1ALDH1A1HSD17B10

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
WO-2002076954-A1 COMPOUNDS USEFUL AS KINASE INHIBITORS FOR THE TREATMENT OF HYPERPROLIFERATIVE DISEASES SMITHKLINE BEECHAM CORPORATION (US) 2002-10-03 — — WO disclosed
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