SCHEMBL10193664

SCHEMBL10193664

CC(C)(C)[Si](C)(C)OCc1ccc(Nc2ncc(Br)s2)nc1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 5/20 0.45
▸ CCNE1 P24864 3/20 0.38
▸ CDK2 P24941 3/20 0.38
▸ CCNB2 O95067 2/20 0.38
▸ CCNE2 O96020 2/20 0.38
▸ CDK1 P06493 2/20 0.38
▸ CDK4 P11802 2/20 0.38
▸ CCNB1 P14635 2/20 0.38
▸ CCND1 P24385 2/20 0.38
▸ CCND2 P30279 2/20 0.38
▸ CCND3 P30281 2/20 0.38
▸ CCNB3 Q8WWL7 2/20 0.38
▸ FFAR2 O15552 1/20 0.34
▸ CDK5 Q00535 1/20 0.33
▸ MAPK10 P53779 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ FPR3 P25089 1/20 0.31
▸ FPR2 P25090 1/20 0.31
▸ FBP1 P09467 1/20 0.30

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
SCHEMBL2066002 0.84 KDR (0.46) KDRCCNE1CDK2CCNB2CCNE2
SCHEMBL3530561 0.80 KDR (0.47) KDRCCNE1CDK2CCNB2CCNE2
SCHEMBL2068548 0.75 KDR (0.55) KDRCCNE1CDK2CCNB2CCNE2
SCHEMBL508700 0.73 CYP11B1 (0.36) —
SCHEMBL24675987 0.72 MAPT (0.30) —
SCHEMBL3662587 0.71 CYP11B1 (0.48) CDK2
SCHEMBL4510215 0.71 DEGS1 (0.42) SMN1; SMN2
SCHEMBL4050106 0.70 APP (0.35) —
SCHEMBL481257 0.70 IDO1 (0.50) SMN1; SMN2
SCHEMBL1535653 0.69 TSHR (0.36) SMN1; SMN2

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-8148400-B2 Thiazolyl compounds useful as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2012-04-03 — — US disclosed
US-20100048581-A1 THIAZOLYL COMPOUNDS USEFUL AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2010-02-25 — — 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-20100048581-A1 THIAZOLYL COMPOUNDS USEFUL AS KINASE INHIBITORS ERBB2, TEC, TTBK1 KDR 672/4885CCNE1 942/4885CDK2 167/4885

“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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