SCHEMBL7476837

SCHEMBL7476837

Cc1c(C)n(C/C=C/c2ccccc2)c2c(Cl)nncc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 5/20 0.40
LMNA P02545 1/20 0.38
TSHR P16473 2/20 0.36
HTR2A P28223 5/20 0.36
CHRM2 P08172 2/20 0.36
CHRM4 P08173 2/20 0.36
CHRM5 P08912 2/20 0.36
ADRA2A P08913 2/20 0.36
CHRM1 P11229 2/20 0.36
ADRB3 P13945 2/20 0.36
ADRA2C P18825 2/20 0.36
CHRM3 P20309 2/20 0.36
S1PR1 P21453 2/20 0.36
FPR1 P21462 2/20 0.36
SLC6A2 P23975 2/20 0.36
HRH2 P25021 2/20 0.36
FPR3 P25089 2/20 0.36
AGTR1 P30556 2/20 0.36
GPR183 P32249 2/20 0.36
OPRM1 P35372 2/20 0.36

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
SCHEMBL7476839 1.00 NPSR1 (0.40) NPSR1LMNATSHRHTR2ACHRM2
SCHEMBL7479782 0.82 CYP1A2 (0.31)
SCHEMBL7475890 0.81 CYP1A2 (0.31)
SCHEMBL7476324 0.80 CYP1A2 (0.50) NPSR1LMNATSHRHTR2ACHRM2
SCHEMBL7476321 0.80 CYP1A2 (0.50) NPSR1LMNATSHRHTR2ACHRM2
SCHEMBL9754273 0.79 FABP4 (0.49) NPSR1LMNATSHRALDH1A1SMN1; SMN2
SCHEMBL27477249 0.79 NPSR1 (0.34) NPSR1LMNATSHRHTR2ACHRM2
SCHEMBL27477248 0.79 NPSR1 (0.34) NPSR1LMNATSHRHTR2ACHRM2
SCHEMBL7473848 0.78 SMN1; SMN2 (0.33) LMNAALDH1A1TP53GAASMN1; SMN2
SCHEMBL7479363 0.78 CYP1A2 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0742218-B1 PYRROLOPYRIDAZINE DERIVATIVE SANKYO CO (JP) 2002-12-04 EP disclosed
US-6063782-A Pyrrolopyridazine derivatives SANKYO COMPANY, LIMITED (JP) 2000-05-16 US disclosed
EP-0742218-A1 PYRROLOPYRIDAZINE DERIVATIVE SANKYO COMPANY LIMITED (JP) 1996-11-13 EP disclosed