SCHEMBL14083397

SCHEMBL14083397

COc1cccnc1-c1ccc(C(=O)Nc2ccnc(Cl)c2)cc1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.47
▸ SMN1; SMN2 Q16637 4/20 0.47
▸ MEN1 O00255 3/20 0.47
▸ KMT2A Q03164 3/20 0.47
▸ NPC1 O15118 3/20 0.47
▸ RAB9A P51151 3/20 0.47
▸ POLB P06746 2/20 0.47
▸ THRB P10828 2/20 0.47
▸ TP53 P04637 1/20 0.47
▸ GRM4 Q14833 3/20 0.47
▸ HDAC6 Q9UBN7 1/20 0.47
▸ AURKB Q96GD4 1/20 0.46
▸ KCNQ3 O43525 1/20 0.46
▸ KCNQ2 O43526 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.45
▸ PKM P14618 1/20 0.45
▸ GRM5 P41594 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ KDM4E B2RXH2 2/20 0.43
▸ HPGD P15428 1/20 0.43

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
SCHEMBL14083315 0.94 POLB (0.52) MAPTSMN1; SMN2MEN1KMT2ANPC1
SCHEMBL14083114 0.90 KCNQ3 (0.54) SMN1; SMN2MEN1KMT2ANPC1RAB9A
SCHEMBL14083380 0.88 GRM4 (0.61) MAPTSMN1; SMN2MEN1KMT2ANPC1
SCHEMBL14083808 0.88 POLB (0.51) MAPTSMN1; SMN2MEN1KMT2ANPC1
SCHEMBL14083377 0.88 AURKB (0.54) MAPTSMN1; SMN2MEN1KMT2ANPC1
SCHEMBL14083399 0.88 KCNQ3 (0.62) MAPTSMN1; SMN2MEN1KMT2AKCNQ3
SCHEMBL14083375 0.88 NPC1 (0.57) MAPTSMN1; SMN2MEN1KMT2ANPC1
SCHEMBL14083379 0.87 TRPV1 (0.55) MAPTSMN1; SMN2MEN1KMT2ANPC1
SCHEMBL14083145 0.86 TRPV1 (0.53) SMN1; SMN2NPC1RAB9APOLBGRM4
SCHEMBL14083392 0.84 SMN1; SMN2 (0.56) MAPTSMN1; SMN2MEN1KMT2APOLB

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 MAPT 2822/4885SMN1; SMN2 2099/4885MEN1 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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