SCHEMBL7258141

SCHEMBL7258141

CSc1ccc(-c2cc(-c3ccccc3)oc(=O)c2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.55
RAB9A P51151 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
KDM4E B2RXH2 1/20 0.55
ALDH1A1 P00352 1/20 0.55
GLA P06280 1/20 0.55
GAA P10253 1/20 0.55
MAPT P10636 1/20 0.55
PTGS2 P35354 2/20 0.53
AR P10275 2/20 0.48
PRKDC P78527 1/20 0.41
CCNC P24863 3/20 0.40
CDK8 P49336 3/20 0.40
PLA2G2A P14555 3/20 0.40
PLA2G4A P47712 3/20 0.40
GABRP O00591 1/20 0.38
GABRD O14764 1/20 0.38
NPC1 O15118 1/20 0.38
CA12 O43570 1/20 0.38
TNKS O95271 1/20 0.38

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
SCHEMBL8366506 0.85 PRKDC (0.51) HPGDRAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL28383699 0.79 CYP1A2 (0.52) RAB9ASMN1; SMN2KDM4EALDH1A1AR
SCHEMBL28384841 0.79 ALDH1A1 (0.56) HPGDRAB9ASMN1; SMN2ALDH1A1AR
SCHEMBL28384631 0.79 ALDH1A1 (0.56) HPGDRAB9ASMN1; SMN2ALDH1A1AR
SCHEMBL28383892 0.79 CYP1A2 (0.52) RAB9ASMN1; SMN2KDM4EALDH1A1AR
SCHEMBL6827288 0.79 TNKS (0.51) ARPRKDCCCNCCDK8PLA2G2A
SCHEMBL6827690 0.79 TNKS (0.51) ARPRKDCCCNCCDK8PLA2G2A
SCHEMBL6824581 0.78 EGFR (0.58) HPGDRAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL28887784 0.78 EGFR (0.58) HPGDRAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL7258144 0.77 ALDH1A1 (0.58) HPGDRAB9ASMN1; SMN2KDM4EALDH1A1

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-2003006451-A1 4-PHENYLPYRAN-2-ONE DERIVATIVES ALMIRALL PRODESFARMA S.A. (ES) 2003-01-23 WO disclosed