SCHEMBL2175357

SCHEMBL2175357

NC(=O)OC1CCc2ccccc21

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 4/20 0.61
HTR2C P28335 1/20 0.44
OPRM1 P35372 1/20 0.44
DRD3 P35462 1/20 0.44
AVPR1A P37288 1/20 0.44
OPRK1 P41145 1/20 0.44
PIN1 Q13526 2/20 0.43
HSD11B1 P28845 1/20 0.42
FFAR1 O14842 3/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CHRM4 P08173 1/20 0.41
DRD2 P14416 1/20 0.41
HTR7 P34969 1/20 0.41
CTSV O60911 1/20 0.41
CTSL P07711 1/20 0.41
CTSS P25774 1/20 0.41
CTSK P43235 1/20 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
SCHEMBL11142136 0.86 IDO1 (0.59) IDO1HTR2COPRM1DRD3AVPR1A
SCHEMBL29590253 0.86 IDO1 (0.59) IDO1HTR2COPRM1DRD3AVPR1A
SCHEMBL8308445 0.84 IDO1 (0.58) IDO1HTR2COPRM1DRD3AVPR1A
SCHEMBL30908530 0.83 IDO1 (0.56) IDO1HTR2COPRM1DRD3AVPR1A
SCHEMBL817976 0.83 IDO1 (0.56) IDO1HTR2COPRM1DRD3AVPR1A
SCHEMBL1455049 0.82 IDO1 (0.56) IDO1HTR2COPRM1DRD3AVPR1A
SCHEMBL8558598 0.80 IDO1 (0.53) IDO1HTR2COPRM1DRD3AVPR1A
SCHEMBL19911672 0.79 IDO1 (0.44) IDO1PIN1HSD11B1CA1CA2
SCHEMBL19911668 0.79 IDO1 (0.44) IDO1PIN1HSD11B1CA1CA2
SCHEMBL19911671 0.79 IDO1 (0.47) IDO1PIN1HSD11B1CA1CA2

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 55 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3423431-B1 CARBAMATE DERIVATIVE COMPOUNDS AND THEIR USES BIO PHARM SOLUTIONS CO LTD (KR) 2023-11-29 EP claimed
CN-1211322-C Separating agent comprising polysaccharide derivative having polycyclic structure DAICEL CHEM (JP) 2005-07-20 CN claimed
EP-3406142-B1 SELECTIVE SPHINGOSINE 1 PHOSPHATE RECEPTOR MODULATORS AND METHODS OF CHIRAL SYNTHESIS CELGENE INT II SARL (CH) 2020-12-23 EP disclosed
EP-2706999-B1 SELECTIVE HETEROCYCLIC SPHINGOSINE 1 PHOSPHATE RECEPTOR MODULATORS CELGENE INT II SARL (CH) 2019-08-28 EP disclosed
WO-2019078171-A1 METHOD FOR CONCENTRATING OR SEPARATING POLYMER COMPOUND 国立大学法人京都大学 2019-04-25 WO disclosed
US-10239846-B2 Selective sphingosine 1 phosphate receptor modulators and methods of chiral synthesis CELGENE INTERNATIONAL II SÀRL (CH) 2019-03-26 US disclosed
EP-3406142-A1 SELECTIVE SPHINGOSINE 1 PHOSPHATE RECEPTOR MODULATORS AND METHODS OF CHIRAL SYNTHESIS Celgene International II Sàrl (CH) 2018-11-28 EP disclosed
CN-105061350-B The sphingosine 1-phosphate receptor modulators and Chiral Synthesis of selectivity 赛尔基因第二国际有限公司 2018-05-29 CN disclosed
EP-2498609-B1 SELECTIVE HETEROCYCLIC SPHINGOSINE 1 PHOSPHATE RECEPTOR MODULATORS CELGENE INT II SARL (CH) 2018-04-18 EP disclosed
US-20170320839-A1 SELECTIVE SPHINGOSINE 1 PHOSPHATE RECEPTOR MODULATORS AND METHODS OF CHIRAL SYNTHESIS RECEPTOS LLC 2017-11-09 US disclosed
WO-2012158550-A9 SELECTIVE HETEROCYCLIC SPHINGOSINE 1 PHOSPHATE RECEPTOR MODULATORS RECEPTOS, INC. (US) 2017-10-26 WO disclosed
EP-0979240-A1 SERINE PROTEASE INHIBITORS Akzo Nobel N.V. (NL) 2000-02-16 EP disclosed
EP-0975600-A1 HETEROCYCLIC DERIVATIVES AND THEIR USE AS ANTITHROMBOTIC AGENTS Akzo Nobel N.V. (NL) 2000-02-02 EP disclosed
EP-0886647-A1 SERINE PROTEASE INHIBITORS Akzo Nobel N.V. (NL) 1998-12-30 EP disclosed
WO-1998050420-A1 SERINE PROTEASE INHIBITORS AKZO NOBEL N.V. (NL) 1998-11-12 WO disclosed
WO-1998047876-A1 HETEROCYCLIC DERIVATIVES AND THEIR USE AS ANTITHROMBOTIC AGENTS AKZO NOBEL N.V. (NL) 1998-10-29 WO disclosed
WO-1997031937-A1 SERINE PROTEASE INHIBITORS AKZO NOBEL N.V. (NL) 1997-09-04 WO disclosed
WO-1997031939-A1 SERINE PROTEASE INHIBITORS AKZO NOBEL N.V. (NL) 1997-09-04 WO disclosed
WO-1997030073-A1 SERINE PROTEASE INHIBITORS AKZO NOBEL N.V. (NL) 1997-08-21 WO disclosed
US-5187165-A Eseroline derivatives; cholinergic agents; antidepressants HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1993-02-16 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 (2 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-20170320839-A1 SELECTIVE SPHINGOSINE 1 PHOSPHATE RECEPTOR MODULATORS AND METHODS OF CHIRAL SYNTHESIS S1PR1, S1PR3, S1PR2 IDO1 1768/4885HTR2C 895/4885OPRM1 167/4885
US-10239846-B2 Selective sphingosine 1 phosphate receptor modulators and methods of chiral synthesis S1PR1, S1PR3, S1PR2 IDO1 1768/4885HTR2C 895/4885OPRM1 167/4885

“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.