SCHEMBL638040

SCHEMBL638040

COc1ccc(C(=O)OCOC(=O)NCCCCc2ccc(Cl)cc2)cc1.[NaH]

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.50
GLA P06280 1/20 0.50
CNR1 P21554 1/20 0.48
FPR2 P25090 1/20 0.48
ATM Q13315 1/20 0.47
MAPT P10636 3/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
LMNA P02545 1/20 0.46
ALDH1A1 P00352 1/20 0.46
MEN1 O00255 1/20 0.46
POLB P06746 2/20 0.45
HPGD P15428 1/20 0.43

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
SCHEMBL2233475 0.88 KMT2A (0.55) KMT2AGLACNR1FPR2ATM
SCHEMBL916707 0.84 KMT2A (0.46) KMT2AMAPTNPC1RAB9ASMN1; SMN2
SCHEMBL17916743 0.81 RAB9A (0.69) KMT2ACNR1FPR2ATMMAPT
SCHEMBL16562164 0.78 RAB9A (0.67) KMT2ACNR1FPR2ATMMAPT
SCHEMBL637257 0.76 NPC1 (0.54) KMT2AMAPTNPC1RAB9ASMN1; SMN2
SCHEMBL916705 0.75 UTS2R (0.44) MAPTNPC1RAB9ASMN1; SMN2LMNA
SCHEMBL637671 0.72 TAAR1 (0.47) KMT2AMAPTALDH1A1MEN1HPGD
SCHEMBL16562294 0.72 KMT2A (0.70) KMT2ACNR1FPR2MAPTNPC1
SCHEMBL3452433 0.72 POLB (0.68) SMN1; SMN2POLB
SCHEMBL16562203 0.72 CNR1 (0.63) KMT2ACNR1FPR2ATMNPC1

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-1660440-B1 ACYLOXYALKYL CARBAMATE PRODRUGS, METHODS OF SYNTHESIS AND USE XENOPORT INC (US) 2012-02-22 EP disclosed
US-7572830-B2 Acyloxyalkyl carbamate prodrugs, methods of synthesis and use XENOPORT, INC. (US) 2009-08-11 US disclosed
US-20080096960-A1 ACYLOXYALKYL CARBAMATE PRODRUGS, METHODS OF SYNTHESIS AND USE XENOPORT, INC. 2008-04-24 US disclosed
EP-1660440-A2 ACYLOXYALKYL CARBAMATE PRODRUGS, METHODS OF SYNTHESIS AND USE Xenoport, Inc. (US) 2006-05-31 EP disclosed
WO-2005019163-A2 ACYLOXYALKYL CARBAMATE PRODRUGS, METHODS OF SYNTHESIS AND USE XENOPORT, INC. (US) 2005-03-03 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-20080096960-A1 ACYLOXYALKYL CARBAMATE PRODRUGS, METHODS OF SYNTHESIS AND USE APEH, ABAT, SI KMT2A 2442/4885GLA 1307/4885CNR1 151/4885

“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.