SCHEMBL3797396

SCHEMBL3797396

CCCCCC(F)CCCCC

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.48
OPRM1 P35372 1/20 0.48
TSHR P16473 1/20 0.44
THRB P10828 1/20 0.44
LMNA P02545 1/20 0.43
DNM1 Q05193 2/20 0.43
FDPS P14324 4/20 0.40
GPR84 Q9NQS5 3/20 0.39
SPHK1 Q9NYA1 1/20 0.39
FFAR1 O14842 1/20 0.39
CA1 P00915 1/20 0.39
CES2 O00748 1/20 0.39

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
SCHEMBL16135675 0.97 MAPT (0.52) MAPTOPRM1TSHRTHRBLMNA
SCHEMBL18725210 0.97 MAPT (0.52) MAPTOPRM1TSHRTHRBLMNA
SCHEMBL19026469 0.97 MAPT (0.52) MAPTOPRM1TSHRTHRBLMNA
SCHEMBL7565480 0.97 MAPT (0.52) MAPTOPRM1TSHRTHRBLMNA
SCHEMBL7176349 0.97 DNM1 (0.48) MAPTOPRM1TSHRTHRBLMNA
SCHEMBL24926247 0.97 MAPT (0.52) MAPTOPRM1TSHRTHRBLMNA
SCHEMBL10608053 0.97 MAPT (0.52) MAPTOPRM1TSHRTHRBLMNA
SCHEMBL19853017 0.97 MAPT (0.52) MAPTOPRM1TSHRTHRBLMNA
SCHEMBL8173118 0.97 MAPT (0.52) MAPTOPRM1TSHRTHRBLMNA
SCHEMBL7557771 0.97 MAPT (0.52) MAPTOPRM1TSHRTHRBLMNA

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-2010125035-A1 METAL COMPLEX WITH LOW-COORDINATING COUNTERION AS POLYMERIZATION CATALYST FOR ISOBUTES OR AN ISOBUTE-CONTAINING MONOMER COMPOSITION BASF SE (DE) 2010-11-04 WO disclosed