SCHEMBL5952355

SCHEMBL5952355

CC(=O)c1nc2cc(C)c(C)cc2n1COCC[Si](C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.40
KDM4E B2RXH2 5/20 0.40
HTT P42858 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
USP2 O75604 1/20 0.40
IDO1 P14902 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
NPC1 O15118 1/20 0.39
HSD17B10 Q99714 1/20 0.38
POLB P06746 2/20 0.34
LMNA P02545 2/20 0.34
TP53 P04637 1/20 0.34
CYP1A2 P05177 1/20 0.34
TSHR P16473 1/20 0.34
DCTPP1 Q9H773 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.32
CYP3A4 P08684 1/20 0.32
RAB9A P51151 1/20 0.32

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
SCHEMBL5951878 0.91 NPC1 (0.36) MAPTKDM4EHTTTDP1MEN1
SCHEMBL6666918 0.86 NPC1 (0.36) MAPTKDM4EHTTTDP1MEN1
SCHEMBL13373949 0.83 NPC1 (0.37) MAPTKDM4EHTTTDP1MEN1
SCHEMBL5952204 0.83 NPC1 (0.42) MAPTKDM4ENPC1HSD17B10POLB
SCHEMBL5953130 0.81 TDP1 (0.44) KDM4EHTTTDP1NPC1HSD17B10
SCHEMBL5953265 0.81 KDM4E (0.55) KDM4EHTTNPC1HSD17B10POLB
SCHEMBL5951634 0.79 PTGDR2 (0.41) KDM4ETDP1MEN1KMT2AUSP2
SCHEMBL5952186 0.78 NPC1 (0.42) MAPTKDM4ENPC1HSD17B10POLB
SCHEMBL13722629 0.76 NPC1 (0.36) MAPTKDM4ENPC1HSD17B10
SCHEMBL5951467 0.75 NPC1 (0.41) MAPTKDM4EKMT2ANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 MAPT 3479/4885KDM4E 522/4885HTT 4828/4885
US-20040048868-A1 Benzimidazoles CDK9, BMX, CDKN1A MAPT 4186/4885KDM4E 645/4885HTT 4860/4885

“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.