SCHEMBL4532307

SCHEMBL4532307

CCOC(=O)c1ccc(NC(=O)c2nn(COCC[Si](C)(C)C)c3ccc(-c4cncc5ccccc45)cc23)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.45
SMN1; SMN2 Q16637 4/20 0.42
RAB9A P51151 5/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MMP9 P14780 2/20 0.41
MAPT P10636 6/20 0.41
NPC1 O15118 5/20 0.41
HSD17B10 Q99714 2/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
CASP3 P42574 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
SENP6 Q9GZR1 1/20 0.41
MAOA P21397 1/20 0.39
KDM4E B2RXH2 2/20 0.39
EGFR P00533 1/20 0.39
KDR P35968 1/20 0.39
USP2 O75604 1/20 0.38

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
SCHEMBL6277247 0.91 MMP9 (0.43) MEN1KMT2AMMP9NPC1KDR
SCHEMBL951128 0.89 ABL1 (0.42) SMN1; SMN2MMP9MAPTKDRMMP1
SCHEMBL955499 0.82 KDR (0.38) MMP9TSHRKDRMMP1ALDH1A1
SCHEMBL953339 0.82 CYP11B1 (0.46) NPC1
SCHEMBL951815 0.78 GRM5 (0.39) MEN1KMT2AMAPTMAPK1
SCHEMBL5716187 0.78 BACE1 (0.38) MEN1KMT2AMMP9TSHRKDR
SCHEMBL4522971 0.77 DYRK1A (0.65) TP53SMN1; SMN2RAB9AMEN1KMT2A
SCHEMBL954050 0.76 GRM5 (0.37) MAPTKDR
SCHEMBL4521537 0.76 FLT1 (0.44) KDR
SCHEMBL953701 0.75 PIK3C3 (0.41) MEN1KMT2AMAPTMAPK1

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-7482342-B2 Indazolecarboxamide derivatives, preparation and use thereof as CDK1, CDK2 and CDK4 inhibitors SANOFI-AVENTIS (FR) 2009-01-27 US disclosed
US-20060004000-A1 Indazolecarboxamide derivatives, preparation and use thereof as CDK1, CDK2 and CDK4 inhibitors SANOFI-AVENTIS (FR) 2006-01-05 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-20060004000-A1 Indazolecarboxamide derivatives, preparation and use thereof as CDK1, CDK2 and CDK4 inhibitors CDK2, CDK1, CDK4 TP53 118/4885SMN1; SMN2 2906/4885RAB9A 4086/4885

“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.