SCHEMBL5009537

SCHEMBL5009537

Clc1ccc(N2CCN(CCNCc3cc(-c4ccc(N5CCCCC5)cc4)n(-c4ccccc4)n3)CC2)cc1

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MALT1 Q9UDY8 15/20 0.48
CACNA1G O43497 2/20 0.47
DRD2 P14416 2/20 0.46
DRD4 P21917 2/20 0.46

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
SCHEMBL4248009 0.95 CACNA1G (0.43) MALT1CACNA1GDRD2DRD4
SCHEMBL5011602 0.94 CACNA1G (0.52) MALT1CACNA1GDRD2DRD4
SCHEMBL13994809 0.92 CACNA1G (0.48) MALT1CACNA1GDRD2DRD4
SCHEMBL4250460 0.91 MALT1 (0.47) MALT1CACNA1GDRD2DRD4
SCHEMBL4250717 0.88 CACNA1G (0.49) CACNA1GDRD2DRD4
SCHEMBL4249382 0.88 CACNA1G (0.48) CACNA1GDRD2
SCHEMBL4249575 0.87 ADRA1A (0.42) CACNA1GDRD2DRD4
SCHEMBL4246047 0.87 HTR1A (0.45) DRD2
SCHEMBL4250842 0.85 CACNA1G (0.47) CACNA1GDRD2
SCHEMBL4247029 0.85 CACNA1G (0.48) CACNA1GDRD2DRD4

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
US-20080312253-A1 Pharmaceutical compositions containing pyrazole derivatives for treating as serotonin antagonist KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2008-12-18 US claimed
US-20080312253-A1 Pharmaceutical compositions containing pyrazole derivatives for treating as serotonin antagonist KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2008-12-18 US disclosed
US-20080312253-A1 Pharmaceutical compositions containing pyrazole derivatives for treating as serotonin antagonist KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2008-12-18 US disclosed
US-20080312253-A1 Pharmaceutical compositions containing pyrazole derivatives for treating as serotonin antagonist KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2008-12-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080312253-A1 Pharmaceutical compositions containing pyrazole derivatives for treating as serotonin antagonist HTR3A, HTR3B, HTR3E MALT1 733/4885CACNA1G 1316/4885DRD2 54/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.