SCHEMBL14083971

SCHEMBL14083971

O=C(Nc1ccc2ncccc2c1)c1ccc(-c2ncccc2Cl)cn1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 7/20 0.58
▸ RAB9A P51151 6/20 0.58
▸ HTT P42858 1/20 0.58
▸ PABPC1 P11940 1/20 0.56
▸ POLB P06746 2/20 0.55
▸ MEN1 O00255 2/20 0.55
▸ KMT2A Q03164 2/20 0.55
▸ MAPT P10636 1/20 0.55
▸ CASP3 P42574 1/20 0.51
▸ SENP8 Q96LD8 1/20 0.51
▸ SENP7 Q9BQF6 1/20 0.51
▸ SENP6 Q9GZR1 1/20 0.51
▸ TRPV1 Q8NER1 4/20 0.49
▸ ALDH1A1 P00352 2/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ CRHBP P24387 1/20 0.47
▸ CRHR2 Q13324 1/20 0.47
▸ CYP1A2 P05177 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ TSHR P16473 1/20 0.46

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
SCHEMBL14083984 0.90 RAB9A (0.56) NPC1RAB9AHTTPABPC1MEN1
SCHEMBL14083563 0.87 PABPC1 (0.67) NPC1RAB9AHTTPABPC1POLB
SCHEMBL14083057 0.83 TRPV1 (0.50) TRPV1
SCHEMBL14083056 0.83 TRPV1 (0.58) NPC1RAB9AHTTMAPTTRPV1
SCHEMBL14084027 0.83 SMN1; SMN2 (0.53) NPC1RAB9AHTTMEN1KMT2A
SCHEMBL14083051 0.83 ATR (0.51) NPC1RAB9AMAPTTRPV1
SCHEMBL14083627 0.83 NPC1 (0.60) NPC1RAB9AHTTPABPC1POLB
SCHEMBL14083968 0.82 TRPV1 (0.49) TRPV1
SCHEMBL14083913 0.82 GRM4 (0.60) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL14083055 0.82 ACLY (0.56) NPC1RAB9AHTTTRPV1

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 NPC1 1061/4885RAB9A 1914/4885HTT 2699/4885

“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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