SCHEMBL10657571

SCHEMBL10657571

CCCCCCCCC(C)C(C)CCCCCCCC

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.55
TSHR P16473 1/20 0.53
THRB P10828 1/20 0.53
DNM1 Q05193 2/20 0.50
LMNA P02545 1/20 0.50
SPHK1 Q9NYA1 1/20 0.50
ADH1B P00325 1/20 0.46
ADH1C P00326 1/20 0.46
ADH1A P07327 1/20 0.46
ADH4 P08319 1/20 0.46
ADH7 P40394 1/20 0.46
SMPD1 P17405 3/20 0.44
ACE2 Q9BYF1 1/20 0.44
GPR84 Q9NQS5 2/20 0.44
FDPS P14324 2/20 0.44

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
SCHEMBL11480610 1.00 OPRM1 (0.55) OPRM1TSHRTHRBDNM1LMNA
SCHEMBL31169240 1.00 OPRM1 (0.55) OPRM1TSHRTHRBDNM1LMNA
SCHEMBL11469974 1.00 OPRM1 (0.55) OPRM1TSHRTHRBDNM1LMNA
SCHEMBL13858988 1.00 OPRM1 (0.55) OPRM1TSHRTHRBDNM1LMNA
SCHEMBL325629 1.00 OPRM1 (0.55) OPRM1TSHRTHRBDNM1LMNA
SCHEMBL11473381 1.00 OPRM1 (0.55) OPRM1TSHRTHRBDNM1LMNA
SCHEMBL11486416 1.00 OPRM1 (0.55) OPRM1TSHRTHRBDNM1LMNA
SCHEMBL13858888 0.97 OPRM1 (0.58) OPRM1TSHRTHRBDNM1LMNA
SCHEMBL22982430 0.94 OPRM1 (0.50) OPRM1TSHRTHRBDNM1LMNA
SCHEMBL28161558 0.94 OPRM1 (0.50) OPRM1TSHRTHRBDNM1LMNA

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-4764278-A Process for reducing the concentration of haloorganic compounds in water SHELL OIL COMPANY (US) 1988-08-16 US disclosed