SCHEMBL7949533

SCHEMBL7949533

Clc1cccc(C2=CCN(CCCc3nnc4n3CCCCC4)CC2)c1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
PARP1 P09874 5/20 0.44
HTR7 P34969 2/20 0.43
SIGMAR1 Q99720 3/20 0.43
PKM P14618 1/20 0.42
POLB P06746 2/20 0.40
PPARG P37231 1/20 0.40
PPARA Q07869 1/20 0.40
HPGD P15428 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
SCHEMBL7949039 0.89 SIGMAR1 (0.53) GAASMN1; SMN2PARP1SIGMAR1PKM
SCHEMBL7949425 0.87 LMNA (0.52) GAASMN1; SMN2PARP1SIGMAR1PKM
SCHEMBL7959347 0.85 LMNA (0.45) GAASMN1; SMN2PARP1HTR7SIGMAR1
SCHEMBL7960931 0.85 SIGMAR1 (0.56) PARP1SIGMAR1POLBHPGD
SCHEMBL7964099 0.84 HPGD (0.53) PARP1SIGMAR1POLBHPGD
SCHEMBL7960974 0.83 LMNA (0.45) GAASMN1; SMN2PARP1SIGMAR1PKM
SCHEMBL7958937 0.83 PKM (0.52) GAASMN1; SMN2PARP1SIGMAR1PKM
SCHEMBL7957285 0.83 SIGMAR1 (0.53) PARP1SIGMAR1POLB
SCHEMBL7959188 0.83 HPGD (0.51) GAASIGMAR1POLBHPGD
SCHEMBL7959202 0.83 GAA (0.41) GAASMN1; SMN2PARP1SIGMAR1POLB

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