SCHEMBL1311200

SCHEMBL1311200

Cc1ccccc1C1(O)CN(C(=O)O)C1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GRIN2B Q13224 15/20 0.50
▸ OPRM1 P35372 1/20 0.48
▸ OPRD1 P41143 1/20 0.48
▸ OPRK1 P41145 1/20 0.48
▸ OPRL1 P41146 1/20 0.48
▸ HDAC4 P56524 1/20 0.41
▸ APP P05067 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
SCHEMBL5373284 0.83 OPRM1 (0.60) GRIN2BOPRM1OPRD1OPRK1OPRL1
SCHEMBL23357843 0.79 GAA (0.39) GRIN2BOPRM1OPRD1OPRK1OPRL1
SCHEMBL15689661 0.79 OPRM1 (0.48) OPRM1OPRD1OPRK1OPRL1HDAC4
SCHEMBL15689473 0.79 SIGMAR1 (0.53) OPRM1OPRD1OPRK1OPRL1APP
SCHEMBL1311605 0.79 GRIN2B (0.44) GRIN2B
SCHEMBL1669519 0.76 GRIN2B (0.44) GRIN2BOPRM1OPRD1OPRK1OPRL1
SCHEMBL8175778 0.73 OPRM1 (0.56) GRIN2BOPRM1OPRD1OPRK1OPRL1
SCHEMBL29060516 0.73 OPRM1 (0.59) GRIN2BOPRM1OPRD1OPRK1OPRL1
SCHEMBL8070982 0.72 OPRM1 (0.46) GRIN2BOPRM1OPRD1OPRK1OPRL1
SCHEMBL1812162 0.71 CYP11B2 (0.46) GRIN2BOPRM1OPRD1OPRK1OPRL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2342194-B1 OXOAZETIDINE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND USE THEREOF IN HUMAN MEDICINE AND IN COSMETICS GALDERMA RES & DEV (FR) 2018-08-08 — — EP disclosed
US-9981952-B2 Oxazetidine derivatives, process for preparing them and use in human medicine and in cosmetics GALDERMA RESEARCH & DEVELOPMENT (FR) 2018-05-29 — — US disclosed
US-9630949-B2 Oxoazetidine derivatives, process for the preparation thereof and use thereof in human medicine and in cosmetics GALDERMA RESEARCH & DEVELOPMENT (FR) 2017-04-25 — — US disclosed
EP-2726478-B1 OXAZETIDINE DERIVATIVES, PROCESS FOR PREPARING THEM AND USE THEREOF IN HUMAN MEDICINE AND IN COSMETICS GALDERMA RES & DEV (FR) 2017-01-11 — — EP disclosed
US-20160237065-A1 OXAZETIDINE DERIVATIVES, PROCESS FOR PREPARING THEM AND USE IN HUMAN MEDICINE AND IN COSMETICS GALDERMA RESEARCH & DEVELOPMENT (FR) 2016-08-18 — — US disclosed
US-9353083-B2 Oxazetidine derivatives, process for preparing them and use in human medicine and in cosmetics GALDERMA RESEARCH & DEVELOPMENT (FR) 2016-05-31 — — US disclosed
US-20150045559-A1 OXOAZETIDINE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND USE THEREOF IN HUMAN MEDICINE AND IN COSMETICS GALDERMA RESEARCH & DEVELOPMENT (FR) 2015-02-12 — — US disclosed
US-8871187-B2 Oxoazetidine derivatives, process for the preparation thereof and use thereon in human medicine and in cosmetics GALDERMA RESEARCH & DEVELOPMENT (FR) 2014-10-28 — — US disclosed
US-20140228342-A1 OXAZETIDINE DERIVATIVES, PROCESS FOR PREPARING THEM AND USE IN HUMAN MEDICINE AND IN COSMETICS GALDERMA RESEARCH & DEVELOPMENT (FR) 2014-08-14 — — US disclosed
US-20110274638-A1 OXOAZETIDINE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND USE THEREON IN HUMAN MEDICINE AND IN COSMETICS GALDERMA RESEARCH & DEVELOPMENT (FR) 2011-11-10 — — 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 (4 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-20110274638-A1 OXOAZETIDINE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND USE THEREON IN HUMAN MEDICINE AND IN COSMETICS CYP2D6, CYP51A1, CYP2C19 GRIN2B 3788/4885OPRM1 686/4885OPRD1 247/4885
US-20160237065-A1 OXAZETIDINE DERIVATIVES, PROCESS FOR PREPARING THEM AND USE IN HUMAN MEDICINE AND IN COSMETICS MC1R, MCHR1, MCHR2 GRIN2B 737/4885OPRM1 599/4885OPRD1 756/4885
US-20150045559-A1 OXOAZETIDINE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND USE THEREOF IN HUMAN MEDICINE AND IN COSMETICS CYP51A1, TYR, CYP2C19 GRIN2B 4066/4885OPRM1 495/4885OPRD1 174/4885
US-20140228342-A1 OXAZETIDINE DERIVATIVES, PROCESS FOR PREPARING THEM AND USE IN HUMAN MEDICINE AND IN COSMETICS MC1R, MCHR1, MCHR2 GRIN2B 699/4885OPRM1 554/4885OPRD1 780/4885

“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.

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