SCHEMBL7949032

SCHEMBL7949032

Clc1ccc(C2=CCN(CCCc3cnc4n3CCCCC4)CC2)cc1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 8/20 0.52
SMN1; SMN2 Q16637 1/20 0.51
PARP1 P09874 3/20 0.46
AR P10275 1/20 0.44
RAB9A P51151 1/20 0.44
DRD2 P14416 1/20 0.44
HTR1A P08908 2/20 0.43
HPGD P15428 1/20 0.42
HTT P42858 1/20 0.42
PPARG P37231 1/20 0.41
PPARA Q07869 1/20 0.41

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
SCHEMBL7957237 0.99 SIGMAR1 (0.53) SIGMAR1SMN1; SMN2PARP1ARRAB9A
SCHEMBL7949039 0.82 SIGMAR1 (0.53) SIGMAR1SMN1; SMN2PARP1DRD2HTR1A
SCHEMBL7949350 0.80 SIGMAR1 (0.50) SIGMAR1SMN1; SMN2DRD2HTR1A
SCHEMBL7963618 0.78 SIGMAR1 (0.51) SIGMAR1SMN1; SMN2DRD2HTR1A
SCHEMBL7960226 0.78 DRD2 (0.47) SIGMAR1SMN1; SMN2PARP1ARRAB9A
SCHEMBL7963783 0.77 DRD2 (0.48) SIGMAR1SMN1; SMN2PARP1ARRAB9A
SCHEMBL7949425 0.73 LMNA (0.52) SIGMAR1SMN1; SMN2PARP1DRD2HPGD
SCHEMBL7964099 0.72 HPGD (0.53) SIGMAR1PARP1HTR1AHPGDHTT
SCHEMBL7949533 0.72 GAA (0.50) SIGMAR1SMN1; SMN2PARP1HPGDPPARG
SCHEMBL7959188 0.72 HPGD (0.51) SIGMAR1HTR1AHPGD

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
US-6187774-B1 N-PIPERAZINYLALKYLINDAZOLE DERIVATIVES; PSYCHOLOGICAL DISORDERS, SCHIZOPHRENIA; SIDE EFFECT REDUCTION YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 2001-02-13 US disclosed
EP-0885883-A1 FUSED HETEROCYCLIC COMPOUNDS AND PHARMACEUTICAL APPLICATIONS THEREOF YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1998-12-23 EP disclosed