SCHEMBL10480702

SCHEMBL10480702

CCCCCCCCCC(C)CC(C)CCC

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 1/20 0.48
OPRM1 P35372 1/20 0.46
SPHK1 Q9NYA1 1/20 0.43
LMNA P02545 1/20 0.42
TSHR P16473 2/20 0.42
THRB P10828 1/20 0.42
DNM1 Q05193 2/20 0.42
ADH1B P00325 1/20 0.40
ADH1C P00326 1/20 0.40
ADH1A P07327 1/20 0.40
ADH4 P08319 1/20 0.40
ADH7 P40394 1/20 0.40
GPR84 Q9NQS5 3/20 0.38
FDPS P14324 3/20 0.38
FFAR1 O14842 1/20 0.38

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
SCHEMBL4271949 1.00 ACE2 (0.48) ACE2OPRM1SPHK1LMNATSHR
SCHEMBL671306 1.00 ACE2 (0.48) ACE2OPRM1SPHK1LMNATSHR
SCHEMBL4275345 1.00 ACE2 (0.48) ACE2OPRM1SPHK1LMNATSHR
SCHEMBL4276528 0.97 OPRM1 (0.48) ACE2OPRM1SPHK1LMNATSHR
SCHEMBL31274600 0.95 ACE2 (0.50) ACE2OPRM1SPHK1LMNATSHR
SCHEMBL4275206 0.95 ACE2 (0.52) ACE2OPRM1SPHK1LMNATSHR
SCHEMBL4281824 0.95 ACE2 (0.52) ACE2OPRM1SPHK1LMNATSHR
SCHEMBL4276688 0.95 ACE2 (0.52) ACE2OPRM1SPHK1LMNATSHR
SCHEMBL4275317 0.95 ACE2 (0.52) ACE2OPRM1SPHK1LMNATSHR
SCHEMBL4275509 0.95 ACE2 (0.52) ACE2OPRM1SPHK1LMNATSHR

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-4871537-A PHEROMONE THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 1989-10-03 US disclosed