SCHEMBL8966061

SCHEMBL8966061

O=C(c1cncc(-c2ccsc2)c1)c1cccc(N2CCNC(c3ccccc3)C2)n1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PRKCQ Q04759 9/20 0.53
PRKCD Q05655 2/20 0.42
GSK3B P49841 4/20 0.40
NAPEPLD Q6IQ20 1/20 0.37
PRKCA P17252 1/20 0.35
KDR P35968 1/20 0.35
BTK Q06187 1/20 0.35
CHEK2 O96017 1/20 0.35
PDE10A Q9Y233 1/20 0.35
RPS6KB1 P23443 1/20 0.35
HSD17B14 Q9BPX1 1/20 0.34

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
SCHEMBL15930692 0.90 PRKCQ (0.59) PRKCQPRKCDGSK3BNAPEPLDPRKCA
SCHEMBL15930701 0.90 PRKCQ (0.59) PRKCQPRKCDGSK3B
SCHEMBL15930691 0.87 PRKCQ (0.56) PRKCQPRKCDGSK3BNAPEPLDPRKCA
SCHEMBL15930694 0.87 PRKCQ (0.60) PRKCQPRKCDGSK3BNAPEPLDPRKCA
SCHEMBL8966009 0.87 PRKCQ (0.53) PRKCQPRKCDGSK3BNAPEPLDPRKCA
SCHEMBL8965919 0.86 PRKCQ (0.55) PRKCQPRKCDGSK3BNAPEPLDPRKCA
SCHEMBL15930702 0.86 PRKCQ (0.54) PRKCQPRKCDGSK3BNAPEPLDPRKCA
SCHEMBL8966186 0.85 PRKCQ (0.53) PRKCQPRKCDGSK3BNAPEPLDPRKCA
SCHEMBL8966003 0.85 PRKCQ (0.53) PRKCQPRKCDGSK3BNAPEPLDPRKCA
SCHEMBL15930696 0.85 PRKCQ (0.53) PRKCQPRKCDGSK3BNAPEPLDPRKCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140221334-A1 KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2014-08-07 US disclosed
US-8188071-B2 Amino substituted pyridines as potent kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-05-29 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-20140221334-A1 KINASE INHIBITORS MAP3K20, MAP3K1, MAP3K6 PRKCQ 38/4885PRKCD 120/4885GSK3B 152/4885

“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.