SCHEMBL3043722

SCHEMBL3043722

Fc1ccc2[nH]cc(-c3ccnc(Nc4ccc(N5CCNCC5)cc4)n3)c2c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FLT3 P36888 4/20 0.56
▸ KCNH2 Q12809 5/20 0.54
▸ CDK2 P24941 4/20 0.54
▸ CDK1 P06493 2/20 0.54
▸ CCNB1 P14635 2/20 0.54
▸ CCNA2 P20248 1/20 0.54
▸ CCNA1 P78396 1/20 0.54
▸ ACVR1 Q04771 3/20 0.53
▸ PIM1 P11309 2/20 0.51
▸ PIM3 Q86V86 2/20 0.51
▸ MAP3K14 Q99558 1/20 0.51
▸ PIM2 Q9P1W9 1/20 0.51
▸ CCNE1 P24864 2/20 0.51
▸ MYLK4 Q86YV6 2/20 0.51
▸ STK17A Q9UEE5 2/20 0.51
▸ CDK7 P50613 2/20 0.49
▸ CDK9 P50750 2/20 0.49
▸ JAK2 O60674 2/20 0.49
▸ CHEK1 O14757 1/20 0.49
▸ AURKA O14965 1/20 0.49

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
SCHEMBL3049599 0.91 JAK2 (0.60) FLT3KCNH2CDK2CDK1CCNB1
SCHEMBL3042349 0.88 FLT3 (0.56) FLT3KCNH2CDK2CDK1CCNB1
SCHEMBL3042350 0.88 FLT3 (0.56) FLT3KCNH2CDK2CDK1CCNB1
SCHEMBL4517977 0.86 FLT3 (0.73) FLT3CDK2CDK1CCNB1CCNA2
SCHEMBL3048139 0.84 FLT3 (0.63) FLT3KCNH2CDK2CDK1CCNB1
SCHEMBL4555951 0.84 FLT3 (0.65) FLT3CDK2CDK1CCNB1ACVR1
SCHEMBL4444756 0.84 FLT3 (0.54) FLT3CDK2CDK1CCNB1MAP3K14
SCHEMBL3036396 0.84 FLT3 (0.56) FLT3KCNH2CDK2CDK1CCNB1
SCHEMBL3040112 0.84 FLT3 (0.62) FLT3CDK2CDK1CCNB1ACVR1
SCHEMBL3046010 0.83 FLT3 (0.62) FLT3CDK2CDK1CCNB1ACVR1

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-20100267707-A1 Tyrosine Kinase Inhibitors MERCK SHARP & DOHME CORP. (US) 2010-10-21 — — US disclosed
EP-2040546-A2 TYROSINE KINASE INHIBITORS Merck & Co., Inc. (US) 2009-04-01 — — EP disclosed
WO-2007149427-A2 TYROSINE KINASE INHIBITORS MERCK & CO., INC. (US) 2007-12-27 — — 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-20100267707-A1 Tyrosine Kinase Inhibitors ABL1, ERBB2, MET FLT3 11/4885KCNH2 4203/4885CDK2 145/4885

“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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