SCHEMBL9788290

SCHEMBL9788290

CCc1c(O)ccc(C)c1NC1=NCCO1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.50
CFB P00751 1/20 0.46
ADRA2A P08913 5/20 0.38
ADRA1A P35348 3/20 0.38
ADRA2B P18089 4/20 0.33
ADRA2C P18825 4/20 0.33
HTR1D P28221 1/20 0.32
HTR1B P28222 1/20 0.32

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
SCHEMBL9788311 0.83 TAAR1 (0.55) TAAR1CFBADRA2AADRA1AADRA2B
SCHEMBL9788294 0.81 ADRA2A (0.40) TAAR1CFBADRA2AADRA1AADRA2B
SCHEMBL9788281 0.78 ADRA2A (0.40) TAAR1CFBADRA2AADRA1AADRA2B
SCHEMBL9788279 0.78 TAAR1 (0.41) TAAR1CFBADRA2AADRA1AADRA2B
SCHEMBL9788343 0.78 TAAR1 (0.44) TAAR1CFBADRA2AADRA1AADRA2B
SCHEMBL9788292 0.77 TAAR1 (0.42) TAAR1CFBADRA2AADRA1AADRA2B
SCHEMBL7048730 0.76 TAAR1 (0.60) TAAR1CFBADRA2AADRA1AADRA2B
SCHEMBL11440748 0.75 TAAR1 (0.75) TAAR1CFBADRA2AADRA1AADRA2B
SCHEMBL9788288 0.73 CFB (0.38) TAAR1CFBADRA2AADRA1AADRA2B
SCHEMBL9788276 0.73 CFB (0.46) TAAR1CFBADRA2AADRA1AADRA2B

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-5066664-A Control of intraocular bleeding and pressure ALLERGAN, INC. (US) 1991-11-19 US disclosed