SCHEMBL22790299

SCHEMBL22790299

CCCc1c(-c2c(F)cccc2F)noc1C1CC1

nearest known ligand 0.42

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 20/20 0.42
FABP1 P07148 4/20 0.38

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
SCHEMBL12168746 0.84 NR1H4 (0.52) NR1H4FABP1
SCHEMBL22570973 0.83 NR1H4 (0.43) NR1H4FABP1
SCHEMBL28241510 0.83 NR1H4 (0.43) NR1H4FABP1
SCHEMBL20031245 0.83 NR1H4 (0.45) NR1H4FABP1
SCHEMBL19900600 0.82 NR1H4 (0.50) NR1H4FABP1
SCHEMBL19900987 0.82 NR1H4 (0.39) NR1H4FABP1
SCHEMBL20031504 0.79 RET (0.39) NR1H4
SCHEMBL19900022 0.78 NR1H4 (0.48) NR1H4
SCHEMBL19899995 0.78 NR1H4 (0.50) NR1H4
SCHEMBL30437306 0.78 NR1H4 (0.48) 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-2020249064-A1 COMPOUNDS FOR MODULATING FXR NANJING RUIJIE PHARMA CO., LTD. (CN) 2020-12-17 WO disclosed