SCHEMBL5362773

SCHEMBL5362773

C#Cc1ccc(-c2ccccc2O)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.58
HPGD P15428 2/20 0.58
HSD17B10 Q99714 2/20 0.58
BCL2L1 Q07817 1/20 0.58
KDM1A O60341 1/20 0.44
ESR2 Q92731 2/20 0.44
BRD4 O60885 1/20 0.40
NR1I2 O75469 1/20 0.40
SMARCA2 P51531 1/20 0.40
SMARCA4 P51532 1/20 0.40
PBRM1 Q86U86 1/20 0.40
PGR P06401 2/20 0.39
AR P10275 2/20 0.39
APP P05067 1/20 0.39
BACE1 P56817 1/20 0.38
QPCT Q16769 2/20 0.38
ALOX5 P09917 1/20 0.38
QPCTL Q9NXS2 1/20 0.38
KDR P35968 1/20 0.37
CA12 O43570 2/20 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
SCHEMBL3842565 0.84 KEAP1 (0.41) ESR2APPCA12CA2CA4
SCHEMBL714236 0.82 ALDH1A1 (0.83) ALDH1A1HPGDHSD17B10BCL2L1KDM1A
SCHEMBL29443997 0.82 ALDH1A1 (0.83) ALDH1A1HPGDHSD17B10BCL2L1KDM1A
SCHEMBL18189724 0.79 ALDH1A1 (0.79) ALDH1A1HPGDHSD17B10BCL2L1KDM1A
SCHEMBL6925026 0.79 ALDH1A1 (0.58) ALDH1A1HPGDHSD17B10BCL2L1KDM1A
SCHEMBL5345150 0.79 HPGD (0.52) ALDH1A1HPGDHSD17B10BCL2L1KDM1A
SCHEMBL11235690 0.77 CYP2A6 (0.60) ALDH1A1HPGDHSD17B10ARBACE1
SCHEMBL6517747 0.77 ESR2 (0.42) ESR2CA12CA2CA4CA14
SCHEMBL10023983 0.76 PELI1 (0.42) ALDH1A1HPGDHSD17B10KDM1AESR2
SCHEMBL11415648 0.76 BACE1 (0.56) ALDH1A1HPGDHSD17B10BCL2L1KDM1A

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
US-7291692-B2 Polyarylene oxide and method of producing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-11-06 US disclosed
US-20050096452-A1 Polyarylene oxide and method of producing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-05-05 US disclosed