SCHEMBL7963787

SCHEMBL7963787

Cc1ccc(C2=CCN(CCCNNC(=O)NN)CC2)cc1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 6/20 0.48
SIGMAR1 Q99720 7/20 0.48
PARP1 P09874 1/20 0.42
DRD2 P14416 1/20 0.42
KDM4E B2RXH2 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HTR7 P34969 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL7961484 0.90 SIGMAR1 (0.55) HTR1ASIGMAR1DRD2
SCHEMBL7961371 0.90 SIGMAR1 (0.50) HTR1ASIGMAR1DRD2MAPT
SCHEMBL7964085 0.90 SIGMAR1 (0.55) HTR1ASIGMAR1PARP1DRD2HTR7
SCHEMBL7957217 0.89 SIGMAR1 (0.52) HTR1ASIGMAR1PARP1
SCHEMBL7961332 0.85 HTR1A (0.53) HTR1ASIGMAR1PARP1DRD2HTR7
SCHEMBL7959610 0.84 SIGMAR1 (0.48) HTR1ASIGMAR1DRD2
SCHEMBL7963865 0.84 SIGMAR1 (0.46) HTR1ASIGMAR1DRD2KDM4EHTR7
SCHEMBL7957391 0.83 HTR7 (0.47) HTR1ASIGMAR1PARP1DRD2KDM4E
SCHEMBL7949420 0.81 HTR6 (0.43) HTR1ASIGMAR1DRD2HTR7MAPT
SCHEMBL7963788 0.81 SIGMAR1 (0.52) HTR1ASIGMAR1PARP1DRD2KDM4E

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