SCHEMBL18595705

SCHEMBL18595705

CCCCCCC(CCCCCC)C1CCCCCNC1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 1/20 0.36
GNAI3 P08754 2/20 0.36
GNAO1 P09471 2/20 0.36
GNAI1 P63096 2/20 0.36
SIGMAR1 Q99720 2/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
CPN1 P15169 1/20 0.33
CPB2 Q96IY4 1/20 0.33
TSHR P16473 1/20 0.33
SHBG P04278 1/20 0.33
EPHX1 P07099 4/20 0.33
EPHX2 P34913 1/20 0.33

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
SCHEMBL20998420 0.93 CPN1 (0.38) GNAI3GNAO1GNAI1CPN1CPB2
SCHEMBL21725498 0.93 CPN1 (0.38) GNAI3GNAO1GNAI1CPN1CPB2
SCHEMBL22193261 0.93 CPN1 (0.38) GNAI3GNAO1GNAI1CPN1CPB2
SCHEMBL22193247 0.93 CPN1 (0.38) GNAI3GNAO1GNAI1CPN1CPB2
SCHEMBL19881822 0.93 CCR2 (0.35) CCR2GNAI3GNAO1GNAI1SIGMAR1
SCHEMBL26489011 0.92 CPN1 (0.37) GNAI3GNAO1GNAI1SIGMAR1CPN1
SCHEMBL23469399 0.89 CPN1 (0.37) GNAI3GNAO1GNAI1SIGMAR1SLC6A2
SCHEMBL24489170 0.86 GNAO1 (0.40) GNAI3GNAO1GNAI1
SCHEMBL23709494 0.86 CPN1 (0.40) GNAI3GNAO1GNAI1SIGMAR1SLC6A2
SCHEMBL23717658 0.86 GNAO1 (0.40) GNAI3GNAO1GNAI1

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-9586952-B2 Polycyclic estrogen receptor modulators and uses thereof GENENTECH, INC. (US) 2017-03-07 US disclosed