SCHEMBL374110

SCHEMBL374110

COc1cc2c(Oc3ccc(NC(=O)OC(C)(C)C)cc3F)ccnc2cc1OCCCO

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AXL P30530 5/20 0.65
FLT3 P36888 9/20 0.60
FGFR2 P21802 2/20 0.60
PDGFRA P16234 1/20 0.58
MET P08581 5/20 0.57
KDR P35968 2/20 0.57
HDAC2 Q92769 2/20 0.57
HDAC8 Q9BY41 2/20 0.57
HDAC6 Q9UBN7 2/20 0.57
RET P07949 1/20 0.57
PDGFRB P09619 1/20 0.57
KIT P10721 1/20 0.57
HDAC10 Q969S8 1/20 0.56
HDAC11 Q96DB2 1/20 0.56

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
SCHEMBL373837 0.89 MET (0.64) AXLFLT3FGFR2PDGFRAMET
SCHEMBL373915 0.87 MET (0.64) AXLMETKDR
SCHEMBL373942 0.86 FGFR2 (0.59) AXLFLT3FGFR2PDGFRAMET
SCHEMBL14821079 0.81 MET (0.75) AXLFLT3FGFR2PDGFRAMET
SCHEMBL31412935 0.81 MET (0.68) AXLFLT3FGFR2PDGFRAMET
SCHEMBL167217 0.81 AXL (0.70) AXLFLT3FGFR2MET
SCHEMBL29548008 0.80 HDAC2 (0.74) AXLFLT3FGFR2PDGFRAMET
SCHEMBL22521332 0.80 HDAC2 (0.74) AXLFLT3FGFR2PDGFRAMET
SCHEMBL5056203 0.80 PDGFRA (0.72) AXLFLT3FGFR2PDGFRAMET
SCHEMBL5052345 0.79 PDGFRA (0.69) AXLFLT3PDGFRAMETKDR

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-2408300-B1 AMINO ESTER DERIVATIVES, SALTS THEREOF AND METHODS OF USE SUNSHINE LAKE PHARMA CO LTD (CN) 2016-05-11 EP disclosed
US-8232294-B2 Amino ester derivatives, sailts thereof and methods of use Xi, Ning (US) 2012-07-31 US disclosed
EP-2408300-A1 AMINO ESTER DERIVATIVES, SALTS THEREOF AND METHODS OF USE Sunshine Lake Pharma Co., Ltd (CN) 2012-01-25 EP disclosed
WO-2010111063-A1 AMINO ESTER DERIVATIVES, SALTS THEREOF AND METHODS OF USE XI NING (US) 2010-09-30 WO disclosed
US-20100239576-A1 AMINO ESTER DERIVATIVES, SAILTS THEREOF AND METHODS OF USE SUNSHINE LAKE PHARMA CO., LTD. (CN) 2010-09-23 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-20100239576-A1 AMINO ESTER DERIVATIVES, SAILTS THEREOF AND METHODS OF USE SRC, BCAT1, BCAT2 AXL 373/4885FLT3 125/4885FGFR2 1542/4885

“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.