SCHEMBL9633713

SCHEMBL9633713

C/C=C/CC(C/C=C/C)(C/C=C/C)c1ccncc1

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 3/20 0.33
USP2 O75604 1/20 0.31
RAB9A P51151 1/20 0.31
CYP19A1 P11511 1/20 0.31

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
SCHEMBL9633715 1.00 KIF11 (0.33) KIF11USP2RAB9ACYP19A1
SCHEMBL151828 0.67 LOXL2 (0.48) CYP19A1
SCHEMBL1790127 0.66 USP2 (0.41) KIF11USP2RAB9ACYP19A1
SCHEMBL27525586 0.64 CYP1A2 (0.43)
SCHEMBL6561303 0.64 LOXL2 (0.46)
SCHEMBL6561307 0.64 LOXL2 (0.46)
SCHEMBL12497479 0.64 CYP2D6 (0.41) KIF11USP2RAB9A
SCHEMBL27526789 0.63 KIF11 (0.52) KIF11USP2RAB9ACYP19A1
SCHEMBL27871642 0.62 KIF11 (0.46) KIF11USP2RAB9ACYP19A1
SCHEMBL20113017 0.62 CTSD (0.41) RAB9A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0273724-B1 ACID GAS SCRUBBING BY COMPOSITE SOLVENT-SWOLLEN MEMBRANES BEND RESEARCH, INC. (US) 1992-06-17 EP disclosed
EP-0336535-A1 Gas separation by composite solvent-swollen membranes BEND RESEARCH, INC. (US) 1989-10-11 EP disclosed
US-4824443-A HIGHLY POLAR SOLVENT BEND RESEARCH, INC. (US) 1989-04-25 US disclosed
EP-0273724-A2 Acid gas scrubbing by composite solvent-swollen membranes BEND RESEARCH, INC. (US) 1988-07-06 EP disclosed
US-4737166-A SEPARATION OF HYDROGEN SULFIDE AND CARBON DIOXIDE FROM HYDROGEN, CARBON MONOXIDE AND HYDROCARBON GASES; SUPPORTED POLYMER BEND RESEARCH, INC. (US) 1988-04-12 US disclosed