SCHEMBL7593792

SCHEMBL7593792

CCC1=Cc2c(C)cccc2[C]1CC[C]1C(CC)=Cc2c(C)cccc21

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 1/20 0.30

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
SCHEMBL4620488 0.79 PDCD1 (0.36) HTR7
SCHEMBL7595974 0.79 HTR7 (0.33) HTR7
SCHEMBL7591461 0.67 GABRA1 (0.38)
SCHEMBL9627660 0.61 ALDH1A1 (0.44)
SCHEMBL2052191 0.61 CYP2A6 (0.43)
SCHEMBL4613695 0.60 TAAR1 (0.34) HTR7
SCHEMBL4623134 0.59 PDCD1 (0.42) HTR7
SCHEMBL8701012 0.59 TSHR (0.41) HTR7
SCHEMBL598761 0.59 TSHR (0.53) HTR7
SCHEMBL597056 0.58 CYP2A6 (0.45)

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-20020052446-A1 Composition based on monofluorometal complexes BAYER AKTIENGESELLSCHAFT (DE) 2002-05-02 US disclosed