SCHEMBL20031560

SCHEMBL20031560

Cc1c(-c2ccccc2C(F)(F)F)noc1C1CC1

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ NR1H4 Q96RI1 17/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ HSD11B1 P28845 1/20 0.41
▸ GPBAR1 Q8TDU6 1/20 0.41

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
SCHEMBL21840048 0.81 NR1H4 (0.46) NR1H4
SCHEMBL22790253 0.81 NR1H4 (0.53) NR1H4
SCHEMBL29618066 0.80 NR1H4 (0.52) NR1H4
SCHEMBL20031505 0.80 NR1H4 (0.52) NR1H4
SCHEMBL19202562 0.80 NR1H4 (0.55) NR1H4
SCHEMBL22790399 0.80 NR1H4 (0.52) NR1H4
SCHEMBL29904897 0.80 NR1H4 (0.55) NR1H4
SCHEMBL19202559 0.80 NR1H4 (0.57) NR1H4
SCHEMBL20944064 0.80 NR1H4 (0.55) NR1H4
SCHEMBL30436703 0.80 NR1H4 (0.55) NR1H4

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
WO-2018059314-A1 AZABICYCLE DERIVATIVES AND PREPARATION METHOD AND USE THEREOF 四川科伦博泰生物医药股份有限公司 2018-04-05 — — WO disclosed
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