SCHEMBL5952855

SCHEMBL5952855

CCc1cc2nc(-c3n[nH]c4ccc(OC)cc34)[nH]c2cc1C

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 4/20 0.52
FLT3 P36888 4/20 0.52
ABL1 P00519 3/20 0.50
MAP3K8 P41279 4/20 0.49
AMY1A P0DUB6 1/20 0.46
PDPK1 O15530 1/20 0.46
CHEK1 O14757 1/20 0.45
TTK P33981 1/20 0.43
ITK Q08881 1/20 0.43

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
SCHEMBL5952280 0.88 AMY1A (0.58) FGFR1FLT3ABL1MAP3K8AMY1A
SCHEMBL5952048 0.82 FGFR1 (0.60) FGFR1FLT3ABL1MAP3K8PDPK1
SCHEMBL13375118 0.82 MAP2K4 (0.47) FGFR1FLT3MAP3K8PDPK1ITK
SCHEMBL13373864 0.81 MAP3K8 (0.46) FGFR1FLT3ABL1MAP3K8PDPK1
SCHEMBL5951998 0.81 MAP3K8 (0.54) FGFR1FLT3ABL1MAP3K8PDPK1
SCHEMBL5952152 0.81 TTK (0.58) FGFR1MAP3K8TTK
SCHEMBL13373947 0.81 CHEK1 (0.54) FLT3MAP3K8CHEK1
SCHEMBL6283108 0.80 FGFR1 (0.50) FGFR1FLT3ABL1MAP3K8PDPK1
Hydrochloric Acid SCHEMBL5953379 0.80 CHEK1 (0.53) FLT3MAP3K8CHEK1
SCHEMBL5952007 0.79 AMY1A (0.58) FGFR1FLT3ABL1AMY1APDPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060014756-A1 Benzimidazoles AVENTIS PHARMACEUTICALS INC. (US) 2006-01-19 US claimed
US-6897208-B2 Benzimidazoles AVENTIS PHARMACEUTICALS INC. (US) 2005-05-24 US claimed
US-20040048868-A1 Benzimidazoles AVENTISUB LLC 2004-03-11 US claimed
US-8288425-B2 Benzimidazoles AVENTIS PHARMACEUTICALS INC. (US) 2012-10-16 US disclosed
US-8288425-B2 Benzimidazoles AVENTIS PHARMACEUTICALS INC. (US) 2012-10-16 US disclosed
US-20060014756-A1 Benzimidazoles AVENTIS PHARMACEUTICALS INC. (US) 2006-01-19 US disclosed
US-6897208-B2 Benzimidazoles AVENTIS PHARMACEUTICALS INC. (US) 2005-05-24 US disclosed
EP-1441725-A1 BENZIMIDAZOLES AND ANALOGUES AND THEIR USE AS PROTEIN KINASES INHIBITORS Aventis Pharmaceuticals Inc. (US) 2004-08-04 EP disclosed
US-20040048868-A1 Benzimidazoles AVENTISUB LLC 2004-03-11 US disclosed
WO-2003035065-A1 BENZIMIDAZOLES AND ANALOGUES AND THEIR USE AS PROTEIN KINASES INHIBITORS AVENTIS PHARMACEUTICALS INC (US) 2003-05-01 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 (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-20060014756-A1 Benzimidazoles CDK9, BMX, SBK3 FGFR1 583/4885FLT3 161/4885ABL1 55/4885
US-20040048868-A1 Benzimidazoles CDK9, BMX, CDKN1A FGFR1 254/4885FLT3 176/4885ABL1 63/4885

“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.