SCHEMBL14083377

SCHEMBL14083377

COc1cccnc1-c1ccc(C(=O)Nc2ccccc2)cc1Cl

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AURKB Q96GD4 1/20 0.54
▸ KMT2A Q03164 5/20 0.51
▸ MEN1 O00255 4/20 0.51
▸ MAPT P10636 3/20 0.50
▸ NPC1 O15118 3/20 0.50
▸ RAB9A P51151 3/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ POLB P06746 1/20 0.50
▸ THRB P10828 2/20 0.49
▸ TP53 P04637 1/20 0.49
▸ PPARG P37231 1/20 0.49
▸ ALDH1A1 P00352 3/20 0.49
▸ LMNA P02545 2/20 0.49
▸ GRM4 Q14833 2/20 0.49
▸ GRM5 P41594 1/20 0.49
▸ CASP3 P42574 1/20 0.49
▸ SENP7 Q9BQF6 1/20 0.49
▸ HDAC6 Q9UBN7 1/20 0.49
▸ CYP3A4 P08684 1/20 0.48
▸ TSHR P16473 1/20 0.48

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
SCHEMBL14083379 0.92 TRPV1 (0.55) AURKBKMT2AMEN1MAPTNPC1
SCHEMBL14083297 0.91 MEN1 (0.58) AURKBKMT2AMEN1MAPTNPC1
SCHEMBL14083375 0.90 NPC1 (0.57) KMT2AMEN1MAPTNPC1RAB9A
SCHEMBL14083384 0.89 TRPV1 (0.55) AURKBKMT2AMEN1MAPTNPC1
SCHEMBL14083380 0.89 GRM4 (0.61) KMT2AMEN1MAPTNPC1RAB9A
SCHEMBL14083383 0.89 TRPV1 (0.62) MAPTSMN1; SMN2TP53
SCHEMBL14083397 0.88 MAPT (0.47) AURKBKMT2AMEN1MAPTNPC1
SCHEMBL14083399 0.88 KCNQ3 (0.62) KMT2AMEN1MAPTSMN1; SMN2ALDH1A1
SCHEMBL14083381 0.88 TRPV1 (0.63) —
SCHEMBL14083729 0.88 AURKB (0.57) AURKBKMT2AMEN1MAPTNPC1

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-20080200524-A1 Amide compounds as ion channel ligands and uses thereof KELLY MICHAEL G 2008-08-21 — — US disclosed
US-20080200524-A1 Amide compounds as ion channel ligands and uses thereof KELLY MICHAEL G 2008-08-21 — — US disclosed
US-7338950-B2 Amide compounds as ion channel ligands and uses thereof RENOVIS, INC. (US) 2008-03-04 — — US disclosed
US-7338950-B2 Amide compounds as ion channel ligands and uses thereof RENOVIS, INC. (US) 2008-03-04 — — 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-20080200524-A1 Amide compounds as ion channel ligands and uses thereof TRPV1, TRPA1, TRPV2 AURKB 3229/4885KMT2A 4272/4885MEN1 4218/4885

“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.

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