SCHEMBL23760665

SCHEMBL23760665

C=Cc1c(CC)cccc1CC(F)F

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 5/20 0.38
GABRB2 P47870 5/20 0.38
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
HCRTR1 O43613 1/20 0.30
HCRTR2 O43614 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
SCHEMBL1363486 0.84 GABRA1 (0.50) GABRA1GABRB2LMNASMN1; SMN2L3MBTL1
SCHEMBL6285101 0.78 GABRA1 (0.44) GABRA1GABRB2LMNASMN1; SMN2L3MBTL1
SCHEMBL16951737 0.75 GABRA1 (0.46) GABRA1GABRB2LMNASMN1; SMN2L3MBTL1
SCHEMBL24063978 0.75 GABRA1 (0.41) GABRA1GABRB2LMNASMN1; SMN2
SCHEMBL420437 0.72 GABRA1 (0.43) GABRA1GABRB2LMNASMN1; SMN2L3MBTL1
SCHEMBL2775950 0.72 GABRA1 (0.43) GABRA1GABRB2SMN1; SMN2
SCHEMBL26028903 0.71 ALDH1A1 (0.46) GABRA1GABRB2
SCHEMBL11771453 0.71 GABRA1 (0.52) GABRA1GABRB2
SCHEMBL24061530 0.70 GABRA1 (0.42) GABRA1GABRB2LMNASMN1; SMN2
SCHEMBL16952549 0.70 GABRA1 (0.38) GABRA1GABRB2LMNASMN1; SMN2L3MBTL1

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
EP-3436460-B1 FUSED PENTACYCLIC IMIDAZOLE DERIVATIVES AS MODULATORS OF TNF ACTIVITY UCB Biopharma SRL (BE) 2021-08-18 EP disclosed