SCHEMBL16067460

SCHEMBL16067460

CC[C@H](O)Cc1ccc(F)cc1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 3/20 0.53
TDP1 Q9NUW8 1/20 0.46
LMNA P02545 1/20 0.42
IDO1 P14902 1/20 0.41
LOXL2 Q9Y4K0 1/20 0.41
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
PPARG P37231 3/20 0.40
PPARA Q07869 2/20 0.40
EPHX2 P34913 1/20 0.40
CPA1 P15085 1/20 0.40
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39

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
SCHEMBL10585894 1.00 TRPA1 (0.53) TRPA1TDP1LMNAIDO1LOXL2
SCHEMBL29913385 0.91 ESR1 (0.45) TRPA1LMNAESR1ESR2
SCHEMBL13849892 0.85 TRPA1 (0.48) TRPA1TDP1LMNAIDO1LOXL2
SCHEMBL14402399 0.85 TRPA1 (0.48) TRPA1TDP1LMNAIDO1LOXL2
SCHEMBL23347526 0.82 TRPA1 (0.46) TRPA1TDP1
SCHEMBL14402605 0.82 TRPA1 (0.46) TRPA1TDP1
SCHEMBL18779904 0.82 GRIN2D (0.41) TRPA1IDO1PPARGPPARAESR1
SCHEMBL14402400 0.82 GRIN2D (0.41) TRPA1IDO1PPARGPPARAESR1
SCHEMBL106892 0.82 ESR1 (0.59) TDP1LMNAESR1ESR2
SCHEMBL26238707 0.82 GRIN2D (0.41) TRPA1IDO1PPARGPPARAESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2968211-B1 PHENYL ALKYL CARBAMATE COMPOUNDS FOR USE IN PREVENTING OR TREATING EPILEPSY OR EPILEPSY-RELATED SYNDROME BIO PHARM SOLUTIONS CO LTD (KR) 2021-05-12 EP disclosed
WO-2014142519-A1 PHENYL ALKYL CARBAMATE COMPOUNDS FOR USE IN PREVENTING OR TREATING EPILEPSY OR EPILEPSY-RELATED SYNDROME BIO-PHARM SOLUTIONS CO., LTD. (KR) 2014-09-18 WO disclosed