SCHEMBL13318521

SCHEMBL13318521

CCNC(=O)NNC(=O)c1cc(Cl)cc(C)c1NC(=O)c1cc(C(F)(F)F)nn1-c1ncccc1Cl

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.35
JAK1 P23458 1/20 0.35
TYK2 P29597 1/20 0.35
KLKB1 P03952 2/20 0.35
CARM1 Q86X55 4/20 0.34
TRPV1 Q8NER1 1/20 0.34
STIM1 Q13586 1/20 0.34
ORAI1 Q96D31 1/20 0.34
PDE4B Q07343 2/20 0.33
NTRK1 P04629 1/20 0.33
TP53 P04637 1/20 0.33

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
SCHEMBL12911546 0.91 NOTUM (0.37) KLKB1CARM1TRPV1PDE4BTP53
SCHEMBL13073070 0.91 ALDH1A1 (0.36) KLKB1CARM1TRPV1STIM1ORAI1
SCHEMBL13072399 0.90 F10 (0.36) KLKB1CARM1TRPV1PDE4B
SCHEMBL12911536 0.90 PDE4B (0.37) KLKB1CARM1TRPV1PDE4BTP53
SCHEMBL3679335 0.90 PDE4B (0.37) KLKB1CARM1TRPV1PDE4B
SCHEMBL13318512 0.89 KLKB1 (0.35) KLKB1CARM1STIM1ORAI1PDE4B
SCHEMBL12528989 0.89 KLKB1 (0.40) KLKB1CARM1TP53
SCHEMBL12529005 0.89 KLKB1 (0.34) KLKB1CARM1TRPV1STIM1ORAI1
SCHEMBL13318524 0.88 CARM1 (0.36) KLKB1CARM1STIM1ORAI1PDE4B
SCHEMBL12529008 0.88 GRM4 (0.39) TRPV1NTRK1

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-20100137314-A1 HARMFUL ORGANISM CONTROL COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-03 US disclosed
US-20100137314-A1 HARMFUL ORGANISM CONTROL COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-03 US disclosed
US-20100099692-A1 HARMFUL ORGANISM CONTROL COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-04-22 US disclosed
US-20100099692-A1 HARMFUL ORGANISM CONTROL COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-04-22 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 (2 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-20100099692-A1 HARMFUL ORGANISM CONTROL COMPOSITION UQCRC1, UQCRC2, Q6ZSR9 JAK2 3110/4885JAK1 2929/4885TYK2 2381/4885
US-20100137314-A1 HARMFUL ORGANISM CONTROL COMPOSITION UQCRC2, UQCRC1, UQCRB JAK2 3149/4885JAK1 3186/4885TYK2 2741/4885

“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.