SCHEMBL5998979

SCHEMBL5998979

CCOC(=O)c1cccc(Nc2nccc(-c3sc(Cl)nc3C(F)(F)F)n2)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 4/20 0.59
▸ NPC1 O15118 2/20 0.51
▸ RAB9A P51151 2/20 0.51
▸ SMN1; SMN2 Q16637 2/20 0.51
▸ KDM4E B2RXH2 1/20 0.51
▸ CDK2 P24941 6/20 0.49
▸ CDK1 P06493 3/20 0.49
▸ CCNT1 O60563 3/20 0.49
▸ CCNA2 P20248 3/20 0.49
▸ CDK9 P50750 3/20 0.49
▸ CCNB1 P14635 2/20 0.49
▸ CDK7 P50613 2/20 0.49
▸ CCNH P51946 2/20 0.49
▸ CCNA1 P78396 1/20 0.49
▸ ABL1 P00519 1/20 0.48
▸ BCR P11274 1/20 0.48
▸ SRC P12931 1/20 0.48
▸ FGFR1 P11362 2/20 0.45
▸ CDK4 P11802 2/20 0.45
▸ HPGD P15428 1/20 0.44

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
SCHEMBL5998978 0.90 SYK (0.59) SYKNPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL5999180 0.81 SYK (0.49) SYKNPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL6852913 0.80 SYK (0.48) SYKNPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL5732836 0.78 SYK (0.61) SYKNPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL5998636 0.77 SMN1; SMN2 (0.57) SYKNPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL4903303 0.77 ABL1 (0.66) SYKNPC1RAB9ASMN1; SMN2KDM4E
Water SCHEMBL7817247 0.77 SYK (0.59) SYKNPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL1927060 0.76 ABL1 (0.80) SYKNPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL27741349 0.75 CDK2 (0.74) CDK2CDK1CCNT1CCNA2CDK9
SCHEMBL19347450 0.74 SYK (1.00) SYK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7151096-B2 Cyclic compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2006-12-19 — — US disclosed
US-20040235841-A1 Cyclic compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2004-11-25 — — US disclosed
WO-2004078682-A2 CYCLIC COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2004-09-16 — — WO 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-20040235841-A1 Cyclic compounds and compositions as protein kinase inhibitors CDK2, CDK5, CDK1 SYK 2923/4885NPC1 3486/4885RAB9A 2182/4885

“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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