SCHEMBL3024931

SCHEMBL3024931

CC1CN(C(=O)O)CCC1(O)c1ccc(Cl)cc1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.51
ALDH1A1 P00352 1/20 0.51
LMNA P02545 1/20 0.51
MAPT P10636 1/20 0.51
OPRL1 P41146 2/20 0.46
OPRM1 P35372 2/20 0.46
MEN1 O00255 1/20 0.44
CNR2 P34972 3/20 0.44
TET3 O43151 1/20 0.42
FBXL19 Q6PCT2 1/20 0.42
CXXC5 Q7LFL8 1/20 0.42
KDM2B Q8NHM5 1/20 0.42
CXXC4 Q9H2H0 1/20 0.42
KDM2A Q9Y2K7 1/20 0.42
HSD11B1 P28845 8/20 0.41
CNR1 P21554 2/20 0.41
OPRK1 P41145 3/20 0.41
OPRD1 P41143 2/20 0.41

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
SCHEMBL18038731 0.87 OPRL1 (0.59) KMT2AALDH1A1LMNAMAPTOPRL1
SCHEMBL16423480 0.86 KMT2A (0.51) KMT2AALDH1A1MAPTOPRL1OPRM1
SCHEMBL6042399 0.84 KMT2A (0.49) KMT2AALDH1A1LMNAMAPTMEN1
SCHEMBL654443 0.82 KMT2A (0.47) KMT2AALDH1A1LMNAMAPTMEN1
SCHEMBL9876987 0.76 OPRD1 (0.48) OPRL1OPRM1OPRK1OPRD1
SCHEMBL9876994 0.76 OPRD1 (0.48) OPRL1OPRM1OPRK1OPRD1
SCHEMBL9876991 0.76 OPRD1 (0.48) OPRL1OPRM1OPRK1OPRD1
SCHEMBL2229509 0.74 MEN1 (0.62) KMT2AALDH1A1OPRL1OPRM1MEN1
SCHEMBL27790061 0.74 LMNA (0.44) KMT2AALDH1A1LMNAMAPTOPRL1
SCHEMBL6042869 0.74 ALDH1A1 (0.45) KMT2AALDH1A1LMNAMAPTOPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102803258-B Alkyl-heterocyclic carbamate derivatives, their preparation and therapeutic use SAI NUOFEI (FR) 2016-04-20 CN claimed
CN-102803258-A Alkyl-heterocyclic carbamate derivatives, their preparation and therapeutic use SANOFI AVENTIS 2012-11-28 CN claimed
CN-105837565-A ALKYL-HETEROCYCLE CARBAMATE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION 赛诺菲 2016-08-10 CN disclosed
CN-102803258-B Alkyl-heterocyclic carbamate derivatives, their preparation and therapeutic use SAI NUOFEI (FR) 2016-04-20 CN disclosed
CN-102803258-B Alkyl-heterocyclic carbamate derivatives, their preparation and therapeutic use SAI NUOFEI (FR) 2016-04-20 CN disclosed
EP-2173713-B1 Piperidinyl derivatives as modulators of chemokine receptor activity BRISTOL MYERS SQUIBB CO (US) 2016-02-17 EP disclosed
US-8501782-B2 Piperidinyl derivatives as modulators of chemokine receptor activity BRISTOL-MYERS SQUIBB COMPANY (US) 2013-08-06 US disclosed
CN-102803258-A Alkyl-heterocyclic carbamate derivatives, their preparation and therapeutic use SANOFI AVENTIS 2012-11-28 CN disclosed
US-20100204274-A1 PIPERIDINYL DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY BRISTOL-MYERS SQUIBB COMPANY 2010-08-12 US disclosed
EP-2173713-A2 PIPERIDINYL DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY Bristol-Myers Squibb Company (US) 2010-04-14 EP disclosed
WO-2009015164-A2 PIPERIDINYL DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY BRISTOL-MYERS SQUIBB COMPANY (US) 2009-01-29 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-20100204274-A1 PIPERIDINYL DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY CCR2, CXCR1, CCR1 KMT2A 2401/4885ALDH1A1 972/4885LMNA 3591/4885

“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.