SCHEMBL916062

SCHEMBL916062

Cc1ccccc1C(=O)OCCOC(=O)NCC1CCC(C(=O)O)CC1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
VCP P55072 4/20 0.44
HTR7 P34969 3/20 0.43
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
ALDH1A1 P00352 2/20 0.40
CYP2C9 P11712 1/20 0.40
GAA P10253 1/20 0.39
PKM P14618 1/20 0.39
BCHE P06276 1/20 0.39
TSHR P16473 1/20 0.39
CHRM1 P11229 1/20 0.39

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
SCHEMBL915159 0.82 VCP (0.43) VCPKMT2AMEN1ALDH1A1CYP2C9
SCHEMBL915160 0.82 VCP (0.43) VCPKMT2AMEN1ALDH1A1CYP2C9
SCHEMBL916229 0.80 TDP1 (0.50) VCPKMT2AMEN1ALDH1A1GAA
SCHEMBL594858 0.75 ALDH1A1 (0.67) KMT2AMEN1ALDH1A1CYP2C9GAA
SCHEMBL594857 0.75 ALDH1A1 (0.67) KMT2AMEN1ALDH1A1CYP2C9GAA
SCHEMBL4983066 0.75 KMT2A (0.46) KMT2AMEN1ALDH1A1CYP2C9PKM
SCHEMBL915177 0.75 ALDH1A1 (0.43) VCPKMT2AMEN1ALDH1A1CYP2C9
SCHEMBL915175 0.75 ALDH1A1 (0.43) VCPKMT2AMEN1ALDH1A1CYP2C9
SCHEMBL4654803 0.74 ALDH1A1 (0.65) KMT2AMEN1ALDH1A1CYP2C9GAA
SCHEMBL2146869 0.74 KMT2A (0.51) KMT2AMEN1ALDH1A1CYP2C9PKM

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-8372881-B2 Acyloxyalkyl carbamate prodrugs of tranexamic acid, methods of synthesis and use XENOPORT, INC. (US) 2013-02-12 US disclosed
US-20110009483-A1 ACYLOXYALKYL CARBAMATE PRODRUGS OF TRANEXAMIC ACID, METHODS OF SYNTHESIS AND USE XENOPORT, INC. (US) 2011-01-13 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-20110009483-A1 ACYLOXYALKYL CARBAMATE PRODRUGS OF TRANEXAMIC ACID, METHODS OF SYNTHESIS AND USE ACMSD, APEH, CPS1 VCP 3099/4885HTR7 1013/4885KMT2A 1530/4885

“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.