SCHEMBL6569544

SCHEMBL6569544

Cc1ccc(C(=O)N(CC(=O)O)c2ccccc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 1/20 0.56
▸ ADRA2C P18825 1/20 0.51
▸ HPGD P15428 1/20 0.49
▸ MEN1 O00255 3/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ NPC1 O15118 3/20 0.47
▸ RAB9A P51151 2/20 0.47
▸ CES2 O00748 1/20 0.47
▸ CES1 P23141 1/20 0.47
▸ PTGIR P43119 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ GLA P06280 1/20 0.44
▸ TSHR P16473 1/20 0.44

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
SCHEMBL698882 0.88 ADRA2C (0.64) ADRA2CHPGDMEN1KMT2ANPC1
SCHEMBL9809224 0.85 HPGD (0.66) PKMHPGDMEN1KMT2AALDH1A1
SCHEMBL9716677 0.85 ADRA2C (0.53) ADRA2CHPGDMEN1KMT2ANPC1
SCHEMBL9716701 0.83 ADRA2C (0.55) ADRA2CHPGDMEN1KMT2ANPC1
SCHEMBL6174036 0.83 ADRA2C (0.51) ADRA2CHPGDMEN1KMT2ANPC1
SCHEMBL10660695 0.83 BACE1 (0.52) ADRA2CHPGDMEN1KMT2ANPC1
SCHEMBL6570858 0.83 KDM4E (0.63) ADRA2CHPGDMEN1KMT2ANPC1
SCHEMBL4008336 0.82 HPGD (0.59) PKMHPGDKMT2ANPC1RAB9A
SCHEMBL1928093 0.82 PKM (0.54) PKMADRA2CHPGDMEN1KMT2A
SCHEMBL12031549 0.82 NPC1 (0.67) PKMMEN1KMT2ANPC1RAB9A

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
JP-9124595-A — — None — — JP disclosed
EP-0838448-B1 Process for the separation of a mixture of enantiomers DSM IP ASSETS BV (NL) 2004-04-21 — — EP disclosed
US-6465684-B2 DIASTEREOMER COMPLEX OF AT LEAST THREE COMPOUNDS, AT LEAST ONE IS A RESOLVING AGENT IN OPTICALLY ACTIVE FORM, AND AT LEAST ONE IS AN ENANTIOMER IN OPTICALLY ACTIVE FORM; RAPID SEPARATION DSM N.V. (NL) 2002-10-15 — — US disclosed
US-20010051747-A1 Process for the separation of a mixture of enantiomers DSM N.V. 2001-12-13 — — US disclosed
US-6235927-B1 OPTICAL RESOLUTION OF ENANTIOMORPHS OF COMPLEXES DSM N.V. (NL) 2001-05-22 — — US disclosed
EP-0838448-A1 Process for the separation of a mixture of enantiomers DSM N.V. (NL) 1998-04-29 — — EP disclosed
JP-H09124595-A REAGENT FOR OPTICAL RESOLUTION AND PRODUCTION OF OPTICALLY ACTIVE 3-AMINOPYRROLIDINE DERIVATIVE TORAY IND INC 1997-05-13 — — JP disclosed
EP-0178911-B1 COMPOSITION CONTAINING A PENEM OR CARBAPENEM ANTIBIOTIC SANKYO COMPANY LIMITED (JP) 1992-01-22 — — EP disclosed
US-4757066-A Reduces renal toxicity SANKYO COMPANY LIMITED (JP) 1988-07-12 — — US disclosed
EP-0178911-A2 Composition containing a penem or carbapenem antibiotic SANKYO COMPANY LIMITED (JP) 1986-04-23 — — EP 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-20010051747-A1 Process for the separation of a mixture of enantiomers EPHX2, VKORC1, ALDH1A2 PKM 2297/4885ADRA2C 688/4885HPGD 695/4885

“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.

Send feedback