SCHEMBL11918136

SCHEMBL11918136

Cc1cc2c(C=O)nc(-c3ccc(Cl)c(F)c3)nc2[nH]1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 1/20 0.40
▸ KIT P10721 8/20 0.36
▸ CYP1A2 P05177 1/20 0.35
▸ ABL1 P00519 1/20 0.35
▸ PDE4D Q08499 1/20 0.34
▸ SGK1 O00141 4/20 0.34
▸ PIM1 P11309 1/20 0.33
▸ PIM2 Q9P1W9 1/20 0.33
▸ HDAC6 Q9UBN7 1/20 0.33
▸ KMO O15229 1/20 0.33
▸ KDR P35968 1/20 0.32

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
SCHEMBL11902934 0.78 TRPV1 (0.39) TRPV1KITCYP1A2ABL1PDE4D
SCHEMBL11917993 0.78 ABL1 (0.37) TRPV1CYP1A2ABL1PDE4DHDAC6
SCHEMBL11918060 0.77 MEP1B (0.33) KIT
SCHEMBL11918068 0.73 ADORA2A (0.37) —
SCHEMBL12885490 0.69 KMO (0.40) TRPV1CYP1A2ABL1PDE4DHDAC6
SCHEMBL11913444 0.68 TRPV1 (0.38) TRPV1CYP1A2ABL1SGK1
SCHEMBL12888472 0.67 CYP1A2 (0.42) TRPV1CYP1A2ABL1PDE4DKMO
SCHEMBL12786040 0.66 GPR68 (0.45) CYP1A2
SCHEMBL11918075 0.65 GPR68 (0.44) CYP1A2
SCHEMBL11913448 0.65 CYP1A2 (0.38) TRPV1CYP1A2ABL1PDE4DSGK1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120202690-A1 HERBICIDAL COMPOUNDS SYNGENTA LIMITED (US) 2012-08-09 — — 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-20120202690-A1 HERBICIDAL COMPOUNDS DDT, HAO2, HAAO TRPV1 2865/4885KIT 4785/4885CYP1A2 75/4885

“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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