SCHEMBL4668288

SCHEMBL4668288

CCCCc1ccoc1C(N)=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.40
HPGD P15428 1/20 0.40
HSD17B10 Q99714 1/20 0.40
ALOX5 P09917 2/20 0.38
EGFR P00533 1/20 0.38
CTRC Q99895 1/20 0.37
TYR P14679 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
THRB P10828 1/20 0.36
AGTR1 P30556 1/20 0.36
AGTR2 P50052 1/20 0.36
GABRP O00591 1/20 0.36
GABRD O14764 1/20 0.36
GABRA1 P14867 1/20 0.36
GABRB1 P18505 1/20 0.36
GABRG2 P18507 1/20 0.36
GABRB3 P28472 1/20 0.36
GABRA5 P31644 1/20 0.36
GABRA3 P34903 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
SCHEMBL30758065 0.89 ALOX5 (0.40) ALDH1A1HPGDHSD17B10ALOX5KDM4E
SCHEMBL8469336 0.87 ALOX5 (0.38) ALDH1A1HPGDHSD17B10ALOX5KDM4E
SCHEMBL38650932 0.87 ALOX5 (0.38) ALDH1A1HPGDHSD17B10ALOX5KDM4E
SCHEMBL38650817 0.87 ALOX5 (0.38) ALDH1A1HPGDHSD17B10ALOX5KDM4E
SCHEMBL18598999 0.84 CTRC (0.38) ALDH1A1HPGDHSD17B10CTRCTYR
SCHEMBL11575458 0.84 KMT2A (0.49) ALDH1A1HPGDHSD17B10KDM4EMAPT
SCHEMBL2303604 0.81 AGTR1 (0.37) ALDH1A1HPGDHSD17B10ALOX5CTRC
SCHEMBL8578166 0.81 BID (0.41) ALDH1A1ALOX5TYRKDM4EMAPT
SCHEMBL23531063 0.80 ALOX5 (0.38) ALDH1A1HSD17B10ALOX5KDM4EMAPT
SCHEMBL4726562 0.78 BID (0.49) ALDH1A1HSD17B10KDM4EMAPTKMT2A

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-1984353-A1 AURORA KINASE MODULATORS AND METHOD OF USE Amgen, Inc (US) 2008-10-29 EP disclosed
WO-2007087276-A1 AURORA KINASE MODULATORS AND METHOD OF USE AMGEN INC. (US) 2007-08-02 WO disclosed