SCHEMBL3538282

SCHEMBL3538282

C[C@H]1CNCCN1c1ccc2[nH]c(-c3n[nH]c4cc(Cl)ccc34)nc2c1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 6/20 0.40
FGFR1 P11362 6/20 0.39
FLT1 P17948 6/20 0.39
KDR P35968 2/20 0.39
CDK4 P11802 3/20 0.38
CCNA2 P20248 3/20 0.38
CCND1 P24385 3/20 0.38
CDK2 P24941 3/20 0.38
CCND3 P30281 3/20 0.38
FLT3 P36888 5/20 0.37
ABL1 P00519 2/20 0.36

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
SCHEMBL3538198 1.00 CHEK1 (0.40) CHEK1FGFR1FLT1KDRCDK4
SCHEMBL3538192 0.93 FGFR1 (0.48) CHEK1FGFR1FLT1KDRCDK4
SCHEMBL3536423 0.93 FGFR1 (0.48) CHEK1FGFR1FLT1KDRCDK4
SCHEMBL3537756 0.85 FGFR1 (0.46) CHEK1FGFR1FLT1KDRCDK4
SCHEMBL5866878 0.81 FGFR1 (0.41) CHEK1FGFR1FLT1KDRFLT3
SCHEMBL3537751 0.78 FGFR1 (0.55) CHEK1FGFR1FLT1KDRCDK4
SCHEMBL3531797 0.78 FGFR1 (0.55) CHEK1FGFR1FLT1KDRCDK4
SCHEMBL3539963 0.77 FGFR1 (0.49) FGFR1FLT1KDRCDK4CCNA2
SCHEMBL3538293 0.76 FGFR1 (0.46) CHEK1FGFR1FLT1KDRCDK4
SCHEMBL3540866 0.76 FGFR1 (0.46) CHEK1FGFR1FLT1KDRCDK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7642278-B2 Nitrogen compounds such as 3-(5-morpholin-4-yl-1H-benz-imidazol-2-yl)-1H-indazole and/or isomers, used as immunology modulators, antidiabetic agents, antiogenesis inhibitors or for prophylaxis of Alzheimer's disease NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2010-01-05 US disclosed
US-7064215-B2 Indazole benzimidazole compounds CHIRON CORPORATION (US) 2006-06-20 US disclosed
US-20060079564-A1 Indazole benzimidazole compounds CHIRON CORPORATION 2006-04-13 US disclosed
EP-1401831-A1 INDAZOLE BENZIMIDAZOLE COMPOUNDS AS TYROSINE AND SERINE/THREONINE KINASE INHIBITORS CHIRON CORPORATION (US) 2004-03-31 EP disclosed
US-20030207883-A1 Indazole benzimidazole compounds CHIRON CORPORATION 2003-11-06 US disclosed
WO-2003004488-A1 INDAZOLE BENZIMIDAZOLE COMPOUNDS AS TYROSINE AND SERINE/THREONINE KINASE INHIBITORS CHIRON CORPORATION (US) 2003-01-16 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 (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-20060079564-A1 Indazole benzimidazole compounds ABL1, ABL2, ALK CHEK1 798/4885FGFR1 886/4885FLT1 2793/4885
US-20030207883-A1 Indazole benzimidazole compounds SLCO1B3, SLCO1B1, SLCO4C1 CHEK1 2932/4885FGFR1 2175/4885FLT1 3562/4885

“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.