SCHEMBL7796205

SCHEMBL7796205

NC(=O)OC(=O)NC[C@H](OC(=O)NC1CC1)c1ccccc1Cl

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.43
TSHR P16473 1/20 0.42
ALDH1A1 P00352 2/20 0.39
GAA P10253 1/20 0.39
AVPR2 P30518 3/20 0.36
AVPR1A P37288 3/20 0.36
OPRM1 P35372 1/20 0.35
OPRL1 P41146 1/20 0.35
P2RX7 Q99572 1/20 0.34
CNR1 P21554 2/20 0.33
BRD4 O60885 2/20 0.33
RAB9A P51151 1/20 0.33
ITGB1 P05556 1/20 0.33
ITGA4 P13612 1/20 0.33
ITGB7 P26010 1/20 0.33
DRD2 P14416 1/20 0.33

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
SCHEMBL7465101 0.86 AVPR2 (0.44) AVPR2AVPR1AOPRM1
SCHEMBL7467171 0.86 AVPR2 (0.44) AVPR2AVPR1AOPRM1
SCHEMBL7476504 0.86 AVPR2 (0.44) AVPR2AVPR1AOPRM1
SCHEMBL8198317 0.84 AVPR2 (0.38) AVPR2AVPR1AOPRM1
SCHEMBL7804157 0.82 ADRB2 (0.39) KMT2AALDH1A1AVPR2AVPR1AOPRM1
SCHEMBL23347538 0.81 KMT2A (0.45) KMT2ATSHRALDH1A1GAAOPRM1
SCHEMBL2904416 0.76 ADRB1 (0.50) OPRM1RAB9A
SCHEMBL7465481 0.76 ADRB1 (0.50) OPRM1RAB9A
SCHEMBL7470205 0.76 ADRB1 (0.50) OPRM1RAB9A
SCHEMBL14477687 0.72 KMT2A (0.44) KMT2ATSHRALDH1A1GAAOPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20010034365-A1 Halogen substituted carbamate compounds from 2-phenyl-1,2-ethanediol CHOI YONG MOON (US) 2001-10-25 US disclosed
US-6127412-A TREATMENT OF DISORDERS OF THE CENTRAL NERVOUS SYSTEM, ESPECIALLY AS ANTICONVULSANTS, ANTIEPILEPTIC AND NEUROPROTECTIVE AGENTS AND CENTRALLY ACTING MUSCLE RELAXANTS SK CORPORATION (US) 2000-10-03 US disclosed
US-6103759-A COMPRISING PURE ENANTIOMERIC FORMS, AS WELL AS ENANTIOMERIC MIXTURES, OF (2-(2-CHLOROPHENYL)-2-HYDROXYETHYL)OXYCARBOXAMIDE; USEFUL FOR TRATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS SK CORPORATION (US) 2000-08-15 US disclosed
US-5854283-A Halogen substituted carbamate compounds from 2-phenyl-1,2-ethanediol YUKONG LIMITED (KR) 1998-12-29 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 (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-20010034365-A1 Halogen substituted carbamate compounds from 2-phenyl-1,2-ethanediol DDT, GRIK2, GABRD KMT2A 471/4885TSHR 2528/4885ALDH1A1 1019/4885

“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.