SCHEMBL14083708

SCHEMBL14083708

COc1ccc(NC(=O)c2ccc(-c3ncccc3Cl)c(F)c2)cc1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNQ3 O43525 1/20 0.53
▸ KCNQ2 O43526 1/20 0.53
▸ PDE4D Q08499 2/20 0.52
▸ AURKB Q96GD4 1/20 0.50
▸ SMN1; SMN2 Q16637 5/20 0.49
▸ NPC1 O15118 5/20 0.49
▸ RAB9A P51151 4/20 0.49
▸ GRM4 Q14833 3/20 0.48
▸ NAMPT P43490 1/20 0.47
▸ POLB P06746 1/20 0.47
▸ ABL1 P00519 1/20 0.46
▸ BCR P11274 1/20 0.46
▸ HDAC6 Q9UBN7 1/20 0.46
▸ TRPV1 Q8NER1 3/20 0.45
▸ MAPT P10636 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ GLA P06280 1/20 0.45

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
SCHEMBL14083702 0.92 NPC1 (0.55) KCNQ3KCNQ2PDE4DSMN1; SMN2NPC1
SCHEMBL14083662 0.92 SMN1; SMN2 (0.59) KCNQ3KCNQ2SMN1; SMN2NPC1RAB9A
SCHEMBL14082836 0.92 AURKB (0.56) PDE4DAURKBSMN1; SMN2NPC1RAB9A
SCHEMBL14083721 0.88 TRPV1 (0.50) KCNQ3KCNQ2SMN1; SMN2NPC1RAB9A
SCHEMBL14083709 0.86 SMN1; SMN2 (0.55) KCNQ3KCNQ2SMN1; SMN2RAB9AGRM4
SCHEMBL14083098 0.86 SMN1; SMN2 (0.59) KCNQ3KCNQ2SMN1; SMN2NPC1RAB9A
SCHEMBL14083634 0.86 RAB9A (0.53) KCNQ3KCNQ2SMN1; SMN2NPC1RAB9A
SCHEMBL14083836 0.85 GRM4 (0.53) KCNQ3KCNQ2AURKBSMN1; SMN2NPC1
SCHEMBL14083883 0.85 TRPV1 (0.63) AURKBSMN1; SMN2NPC1RAB9AGRM4
SCHEMBL14083640 0.84 RAB9A (0.55) KCNQ3KCNQ2SMN1; SMN2NPC1RAB9A

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 KCNQ3 87/4885KCNQ2 67/4885PDE4D 1812/4885

“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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