SCHEMBL2139149

SCHEMBL2139149

Cc1sc(C2CCCN2C(=O)CCl)cc1C(=O)Nc1ncc(Cl)s1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOA P21397 3/20 0.37
AADAT Q8N5Z0 1/20 0.36
GCK P35557 1/20 0.36
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
CCR2 P41597 1/20 0.35
MAOB P27338 1/20 0.35

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
SCHEMBL2138644 0.90 AHR (0.42) MAOAAADATGCKNPC1RAB9A
SCHEMBL2138294 0.89 MAOA (0.35) MAOAAADATGCK
SCHEMBL2139521 0.85 L3MBTL1 (0.44) NPC1CCR2
Hydrochloric Acid SCHEMBL2135161 0.85 MAOA (0.34) MAOAAADATGCKMAOB
SCHEMBL2141174 0.85 FAP (0.36) MAOAAADATGCKCCR2
SCHEMBL2141769 0.85 MAOA (0.33) MAOAAADATGCKMAOB
SCHEMBL2706273 0.84 MAOA (0.34) MAOAAADATGCK
SCHEMBL2141763 0.82 PRNP (0.32) MAOA
SCHEMBL2139189 0.80 AHR (0.42) MAOAAADATGCKNPC1RAB9A
SCHEMBL2708134 0.79 MEN1 (0.40) AADATNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120101137-A1 NOVEL THIOPHENECARBOXAMIDE DERIVATIVE AND PHARMACEUTICAL USE THEREOF SANWA KAGAKU KENKYUSHO CO., LTD. (JP) 2012-04-26 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-20120101137-A1 NOVEL THIOPHENECARBOXAMIDE DERIVATIVE AND PHARMACEUTICAL USE THEREOF GCK, GCKR, HK2 MAOA 1773/4885AADAT 2057/4885GCK 1/4885

“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.