SCHEMBL7864876

SCHEMBL7864876

O[C@@H]1CCN[C@H](Cc2ccccc2)C1

nearest known ligand 0.65

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.57
PLG P00747 2/20 0.50
GBA1 P04062 2/20 0.44
MEN1 O00255 1/20 0.39
KMT2A Q03164 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
SCHEMBL9112753 1.00 POLB (0.57) POLBPLGGBA1MEN1KMT2A
SCHEMBL7864879 1.00 POLB (0.57) POLBPLGGBA1MEN1KMT2A
SCHEMBL26210924 0.83 LTA4H (0.40) POLBPLG
SCHEMBL26210919 0.83 LTA4H (0.40) POLBPLG
SCHEMBL4707927 0.82 POLB (0.47) POLBGBA1MEN1KMT2A
SCHEMBL27316845 0.82 POLB (0.47) POLBGBA1MEN1KMT2A
SCHEMBL27666282 0.81 GBA1 (0.59) POLBPLGGBA1
Hydrochloric Acid SCHEMBL7858639 0.81 MEN1 (0.46) POLBGBA1MEN1KMT2A
SCHEMBL23775740 0.79 POLB (0.57) POLBPLGGBA1MEN1KMT2A
SCHEMBL23775758 0.79 POLB (0.57) POLBPLGGBA1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0869955-B1 N-ACYL-2-SUBSTITUTED-4-(BENZIMIDAZOLYL- OR IMIDAZOPYRIDINYL-SUBSTITUTED RESIDUES)-PIPERIDINES AS TACHYKININ ANTAGONISTS JANSSEN PHARMACEUTICA NV (BE) 2001-10-24 EP disclosed
US-6110939-A AS A SUBSTANCE P ANTAGONISTS TREATING TACHYKININ-MEDIATED DISEASE, ASTHMA, CENTRAL NERVOUS SYSTEM DISORDER JANSSEN PHARMACEUTICA N.V. (BE) 2000-08-29 US disclosed
EP-0532456-B1 1-Acylpiperidine derivatives and their use as substance P antagonists CIBA GEIGY AG (CH) 1995-03-29 EP disclosed
EP-0532456-A1 1-Acylpiperidine derivatives and their use as substance P antagonists CIBA-GEIGY AG (CH) 1993-03-17 EP disclosed