SCHEMBL5248733

SCHEMBL5248733

CN(Cc1cc(Br)cc(Br)c1)CC1(N2CCNCC2)Cc2ccccc2C1

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 5/20 0.37
SIGMAR1 Q99720 3/20 0.35
PYCR1 P32322 1/20 0.31
HTR2C P28335 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
Hydrochloric Acid SCHEMBL4830193 0.99 TACR1 (0.36) TACR1SIGMAR1PYCR1
SCHEMBL5244849 0.88 TACR1 (0.37) TACR1SIGMAR1PYCR1HTR2C
Hydrochloric Acid SCHEMBL4834561 0.87 TACR1 (0.36) TACR1SIGMAR1HTR2C
SCHEMBL5249405 0.86 SIGMAR1 (0.40) SIGMAR1PYCR1HTR2C
SCHEMBL5245183 0.86 TACR1 (0.37) TACR1SIGMAR1HTR2C
Hydrochloric Acid SCHEMBL4835398 0.85 SIGMAR1 (0.39) SIGMAR1PYCR1HTR2C
Hydrochloric Acid SCHEMBL4834834 0.85 TACR1 (0.36) TACR1HTR2C
SCHEMBL5248023 0.83 TACR1 (0.42) TACR1
Hydrochloric Acid SCHEMBL4830251 0.82 TACR1 (0.41) TACR1
SCHEMBL5245485 0.79 TACR1 (0.43) TACR1

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-1707564-B1 Indanyl-piperazine derivatives, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2007-09-12 EP disclosed
EP-1707564-A2 Indanyl-piperazine derivatives, process for their preparation and pharmaceutical compositions containing them Les Laboratoires Servier (FR) 2006-10-04 EP disclosed