SCHEMBL8058170

SCHEMBL8058170

C1=C(c2ccc(-c3ccccc3)cc2)Cc2ccccc21.C1=C(c2ccc(-c3ccccc3)cc2)Cc2ccccc21

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 5/20 0.61
CYP11B1 P15538 4/20 0.61
IP6K1 Q92551 1/20 0.49
IP6K3 Q96PC2 1/20 0.49
PTGS2 P35354 3/20 0.47
CYP19A1 P11511 2/20 0.46
MAOA P21397 1/20 0.46
MAOB P27338 1/20 0.46
NISCH Q9Y2I1 1/20 0.38
ALDH1A1 P00352 1/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
GPR84 Q9NQS5 1/20 0.36
DRD2 P14416 1/20 0.36
DRD4 P21917 1/20 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
SCHEMBL6285180 1.00 CYP11B2 (0.61) CYP11B2CYP11B1IP6K1IP6K3PTGS2
SCHEMBL31608568 0.96 CYP11B2 (0.65) CYP11B2CYP11B1IP6K1IP6K3PTGS2
SCHEMBL319265 0.96 CYP11B2 (0.65) CYP11B2CYP11B1IP6K1IP6K3PTGS2
SCHEMBL31666281 0.94 CYP11B2 (0.62) CYP11B2CYP11B1IP6K1IP6K3PTGS2
SCHEMBL6285178 0.86 CYP11B1 (0.56) CYP11B2CYP11B1IP6K1IP6K3PTGS2
SCHEMBL6287169 0.86 CYP11B1 (0.54) CYP11B2CYP11B1IP6K1IP6K3PTGS2
SCHEMBL30487694 0.86 CYP11B1 (0.54) CYP11B2CYP11B1IP6K1IP6K3PTGS2
SCHEMBL25358298 0.84 CYP11B2 (0.53) CYP11B2CYP11B1IP6K1IP6K3PTGS2
SCHEMBL7091350 0.84 CYP11B2 (0.53) CYP11B2CYP11B1IP6K1IP6K3PTGS2
SCHEMBL7090742 0.84 CYP11B1 (0.53) CYP11B2CYP11B1IP6K1IP6K3PTGS2

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
US-6143842-A CONTINUOUSLY TRANSFERRING POLYOLEFIN, RESIDUAL CATALYST AND UNREACTED MONOMER TO CONDITIONING ZONE OF KNOWN VOLUME AND HEATING; CONTROLLING TRANSFER/REMOVAL OF POLYOLEFIN FROM THE ZONE TO ENABLE MONOMER REMOVAL WITHOUT OVERHEATING POLYOLEFIN HUNTSMAN POLYMERS CORPORATION (US) 2000-11-07 US claimed