SCHEMBL20031245

SCHEMBL20031245

OCc1c(-c2c(F)cccc2F)noc1C1CC1

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 19/20 0.45
RET P07949 1/20 0.42
FABP1 P07148 3/20 0.41
FABP4 P15090 1/20 0.40

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
SCHEMBL19899990 0.92 NR1H4 (0.49) NR1H4RETFABP1FABP4
SCHEMBL19899995 0.91 NR1H4 (0.50) NR1H4RET
SCHEMBL19899994 0.91 NR1H4 (0.40) NR1H4RETFABP1FABP4
SCHEMBL19900884 0.91 NR1H4 (0.51) NR1H4FABP1FABP4
SCHEMBL30437269 0.91 NR1H4 (0.40) NR1H4RETFABP1FABP4
SCHEMBL2084116 0.89 NR1H4 (0.41) NR1H4
SCHEMBL29385188 0.88 NR1H4 (0.52) NR1H4RETFABP1
SCHEMBL19900204 0.88 NR1H4 (0.52) NR1H4RETFABP1
SCHEMBL29386923 0.87 NR1H4 (0.39) NR1H4RETFABP1
SCHEMBL19899942 0.87 NR1H4 (0.39) NR1H4RETFABP1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116887827-A Compounds and methods for modulating FXR 拓臻制药公司 2023-10-13 CN disclosed
WO-2022147448-A1 COMPOUNDS AND METHODS FOR MODULATING FXR TERNS PHARMACEUTICALS, INC. (US) 2022-07-07 WO disclosed
CN-109265471-B FXR receptor agonists 轩竹生物科技有限公司 2021-06-04 CN disclosed
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