SCHEMBL2139189

SCHEMBL2139189

CNCC(=O)N1CCCC1c1cc(C(=O)Nc2ncc(F)s2)c(C)s1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
AHR P35869 1/20 0.42
MAOA P21397 4/20 0.36
AADAT Q8N5Z0 1/20 0.35
GCK P35557 4/20 0.35
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
FFAR2 O15552 4/20 0.34
CCR2 P41597 1/20 0.34
MAOB P27338 2/20 0.34
PRNP P04156 1/20 0.34
PDF Q9HBH1 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL2139572 0.91 AHR (0.40) AHRMAOAAADATGCKMAOB
SCHEMBL2138644 0.90 AHR (0.42) AHRMAOAAADATGCKNPC1
SCHEMBL2138480 0.84 AHR (0.42) AHRMAOAGCKNPC1RAB9A
SCHEMBL2136182 0.84 L3MBTL1 (0.44) AHRNPC1FFAR2CCR2
SCHEMBL2138898 0.83 AHR (0.40) AHRMAOAGCKNPC1RAB9A
SCHEMBL2136512 0.82 AHR (0.37) AHRMAOAAADATGCKFFAR2
SCHEMBL2138028 0.82 AHR (0.36) AHRMAOAAADATGCKFFAR2
SCHEMBL2137992 0.81 AHR (0.35) AHRMAOAAADATGCKFFAR2
SCHEMBL2137980 0.81 AHR (0.36) AHRMAOAAADATGCKPRNP
Hydrochloric Acid SCHEMBL2140025 0.81 AHR (0.36) AHRMAOAAADATGCKPRNP

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 AHR 3039/4885MAOA 1773/4885AADAT 2057/4885

“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.