SCHEMBL749358

SCHEMBL749358

C[Si](C)(C)CCOCn1c(C=O)cnc1C1CCCN1C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 2/20 0.33
BTK Q06187 3/20 0.31
CPT1A P50416 5/20 0.31
CPT2 P23786 3/20 0.31
PRCP P42785 2/20 0.31
AADAT Q8N5Z0 1/20 0.31
CPT1B Q92523 1/20 0.30
SCD O00767 1/20 0.30
SCD5 Q86SK9 1/20 0.30

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
SCHEMBL833485 0.89 ALDH1A1 (0.40)
SCHEMBL205757 0.89 ALDH1A1 (0.40)
SCHEMBL934404 0.86 DGAT1 (0.32) DGAT1BTKCPT1ACPT2PRCP
SCHEMBL933195 0.86 MAPT (0.32) DGAT1CPT1ACPT2PRCPSCD
SCHEMBL933196 0.86 MAPT (0.32) DGAT1CPT1ACPT2PRCPSCD
SCHEMBL934406 0.86 DGAT1 (0.32) DGAT1BTKCPT1ACPT2PRCP
SCHEMBL27978679 0.83 TP53 (0.31) DGAT1CPT1ACPT2PRCPAADAT
SCHEMBL16499389 0.81 F11 (0.32) CPT1ACPT2
SCHEMBL2579925 0.81 F11 (0.36) DGAT1CPT1ACPT2PRCPCPT1B
SCHEMBL750762 0.81 PLAT (0.34) DGAT1PRCP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2419433-B1 HEPATITIS C VIRUS INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2015-03-11 EP disclosed
US-8143414-B2 Hepatitis C virus inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2012-03-27 US disclosed
EP-2430014-A1 ANTIVIRAL COMPOUNDS Gilead Sciences, Inc. (US) 2012-03-21 EP disclosed
US-20110098327-A1 Hepatitis C Virus Inhibitors BRISTOL-MYERS SQUIBB COMPANY 2011-04-28 US disclosed
WO-2010132601-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. (US) 2010-11-18 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-20110098327-A1 Hepatitis C Virus Inhibitors HAVCR2, EIF2AK2, MAVS DGAT1 757/4885BTK 2654/4885CPT1A 142/4885

“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.