SCHEMBL27943266

SCHEMBL27943266

O=CC=CCc1cc(Cl)ccc1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 3/20 0.53
▸ HPGD P15428 3/20 0.53
▸ ALOX15 P16050 3/20 0.53
▸ MEN1 O00255 2/20 0.53
▸ CYP3A4 P08684 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ ALOX12 P18054 2/20 0.53
▸ SMN1; SMN2 Q16637 2/20 0.53
▸ SLC22A1 O15245 1/20 0.53
▸ USP2 O75604 1/20 0.53
▸ LMNA P02545 1/20 0.53
▸ HSP90AA1 P07900 1/20 0.53
▸ MAPT P10636 1/20 0.53
▸ HSPD1 P10809 1/20 0.53
▸ HSPA5 P11021 1/20 0.53
▸ IDO1 P14902 1/20 0.53
▸ CASP1 P29466 1/20 0.53
▸ HTT P42858 1/20 0.53
▸ BLM P54132 1/20 0.53
▸ HSPE1 P61604 1/20 0.53

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
SCHEMBL2597823 0.82 HIF1A (0.61) HIF1AHPGDALOX15MEN1CYP3A4
SCHEMBL20656766 0.76 ALOX15 (0.63) HIF1AHPGDALOX15MEN1CYP3A4
SCHEMBL2835839 0.74 CDK4 (0.47) HIF1AHSPA5IDO1HSD17B10AKR1B1
SCHEMBL28074487 0.74 HPGD (0.61) HIF1AHPGDALOX15MEN1CYP3A4
SCHEMBL2490536 0.74 GABRA1 (0.66) HIF1AHPGDALOX15MEN1CYP3A4
SCHEMBL24074915 0.73 MEN1 (0.54) HIF1AHPGDALOX15MEN1CYP3A4
SCHEMBL27584739 0.73 MEN1 (0.54) HIF1AHPGDALOX15MEN1CYP3A4
SCHEMBL10908436 0.71 HTT (0.60) HIF1AHPGDALOX15MEN1CYP3A4
SCHEMBL7519481 0.71 ALOX15 (0.57) HIF1AHPGDALOX15MEN1CYP3A4
SCHEMBL622778 0.71 HPGD (0.68) HIF1AHPGDALOX15MEN1CYP3A4

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
CN-103382196-A (E)-1-(8-benzopyranyl)-2-allyl-1-one and its analogues, and use thereof UNIV SICHUAN 2013-11-06 — — CN disclosed
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