SCHEMBL6485019

SCHEMBL6485019

NCc1cccc(C2CC[N]CC2)c1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TPSAB1 Q15661 6/20 0.42
PNMT P11086 1/20 0.40
ENPP2 Q13822 1/20 0.40
LOXL2 Q9Y4K0 1/20 0.39
PRMT6 Q96LA8 1/20 0.38
DRD2 P14416 1/20 0.37
DDB1 Q16531 1/20 0.37
CRBN Q96SW2 1/20 0.37
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
KCNH2 Q12809 1/20 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
SCHEMBL3176710 0.87 PNMT (0.47) TPSAB1PNMTENPP2LOXL2PRMT6
Hydrochloric Acid SCHEMBL13570531 0.85 PNMT (0.45) TPSAB1PNMTENPP2LOXL2PRMT6
SCHEMBL30531117 0.84 PRMT6 (0.44) TPSAB1PNMTENPP2LOXL2PRMT6
SCHEMBL16368536 0.84 HDAC4 (0.47) TPSAB1PNMTENPP2LOXL2PRMT6
SCHEMBL25359641 0.84 PRMT6 (0.44) TPSAB1PNMTENPP2LOXL2PRMT6
SCHEMBL1365912 0.83 SIGMAR1 (0.42) DRD2
Hydrochloric Acid SCHEMBL15922780 0.82 TPSAB1 (0.43) TPSAB1PNMTENPP2LOXL2PRMT6
SCHEMBL8287053 0.82 KMO (0.49) TPSAB1PNMTENPP2LOXL2PRMT6
Hydrochloric Acid SCHEMBL16343416 0.82 HDAC4 (0.46) TPSAB1PNMTENPP2LOXL2PRMT6
SCHEMBL27585548 0.81 TPSAB1 (0.43) TPSAB1PNMTENPP2LOXL2PRMT6

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-2485678-A1 COFERONS AND METHODS OF MAKING AND USING THEM Cornell University (US) 2012-08-15 EP disclosed
US-20120142735-A1 DISUBSTITUTED [4-(5-AMINOMETHYL-PHENYL)-PIPERIDIN-1-YL]- 1H-INDOL-3-YL]-METHANONES SANOFI (FR) 2012-06-07 US disclosed
US-6977263-B2 Chemical compounds AVENTIS PHARMACEUTICALS INC. (US) 2005-12-20 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-20120142735-A1 DISUBSTITUTED [4-(5-AMINOMETHYL-PHENYL)-PIPERIDIN-1-YL]- 1H-INDOL-3-YL]-METHANONES CMA1, TPSB2, TPSAB1 TPSAB1 3/4885PNMT 240/4885ENPP2 718/4885

“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.