SCHEMBL14834288

SCHEMBL14834288

O=C(C=Cc1ccccc1)NC1CCN(C(=O)OC(C(F)(F)F)C(F)(F)F)CC1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.52
HTR2A P28223 1/20 0.52
HTR2C P28335 1/20 0.52
HTR2B P41595 1/20 0.52
SIGMAR1 Q99720 1/20 0.52
MGLL Q99685 4/20 0.48
CCR3 P51677 2/20 0.48
KDM5A P29375 1/20 0.47
ABHD6 Q9BV23 1/20 0.45
MAPT P10636 1/20 0.44
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL14834286 1.00 DRD2 (0.52) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL14834122 0.89 MAPT (0.48) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL14834125 0.89 MAPT (0.48) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL14834017 0.85 MGLL (0.52) MGLLMAOAMAOBSMN1; SMN2
SCHEMBL15050814 0.85 MGLL (0.52) MGLLMAOAMAOBSMN1; SMN2
SCHEMBL14834457 0.81 BCHE (0.48) MGLLABHD6MAOAMAOBSMN1; SMN2
SCHEMBL15050749 0.81 BCHE (0.48) MGLLABHD6MAOAMAOBSMN1; SMN2
SCHEMBL27900180 0.80 DRD2 (0.64) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL27900177 0.80 DRD2 (0.64) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL14834256 0.79 EPHX2 (0.57) DRD2MGLLRAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2576507-B1 HEXAFLUOROISOPROPYL CARBAMATE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI SA (FR) 2017-04-05 EP disclosed
EP-2576507-A1 HEXAFLUOROISOPROPYL CARBAMATE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI (FR) 2013-04-10 EP disclosed
WO-2011151808-A1 HEXAFLUOROISOPROPYL CARBAMATE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI (FR) 2011-12-08 WO disclosed