SCHEMBL6723950

SCHEMBL6723950

NC(C(=O)Nc1cccc(Cl)c1)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.59
RAB9A P51151 4/20 0.59
MAPT P10636 4/20 0.59
MEN1 O00255 4/20 0.59
KMT2A Q03164 4/20 0.59
LMNA P02545 3/20 0.59
HTT P42858 3/20 0.59
ALDH1A1 P00352 4/20 0.57
HPGD P15428 1/20 0.57
CASR P41180 1/20 0.56
ROCK2 O75116 1/20 0.53
ROCK1 Q13464 1/20 0.53
KDM4E B2RXH2 2/20 0.52
TP53 P04637 1/20 0.52
BAZ1A Q9NRL2 1/20 0.52
EGFR P00533 1/20 0.50
MMP1 P03956 1/20 0.50
MMP2 P08253 1/20 0.50
MMP9 P14780 1/20 0.50
MAOA P21397 1/20 0.50

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
SCHEMBL28304126 1.00 NPC1 (0.59) NPC1RAB9AMAPTMEN1KMT2A
SCHEMBL19074543 0.84 POLB (0.66) NPC1RAB9AMAPTMEN1KMT2A
SCHEMBL4982071 0.84 POLB (0.66) NPC1RAB9AMAPTMEN1KMT2A
SCHEMBL8370173 0.83 NPC1 (0.61) NPC1RAB9AMAPTMEN1KMT2A
SCHEMBL6723553 0.83 ROCK2 (0.58) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL3836963 0.83 ROCK2 (0.58) NPC1RAB9AMEN1KMT2AALDH1A1
Hydrochloric Acid SCHEMBL8010083 0.82 POLB (0.63) NPC1RAB9AMAPTMEN1KMT2A
Hydrochloric Acid SCHEMBL8010089 0.82 POLB (0.63) NPC1RAB9AMAPTMEN1KMT2A
SCHEMBL20418409 0.82 ROCK2 (0.53) NPC1RAB9AMEN1KMT2ALMNA
SCHEMBL6723310 0.82 HSD17B10 (0.54) MAPTMEN1KMT2ALMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110041285-B Preparation method of 2, 4, 5-trisubstituted oxazole compound 大连理工大学 2021-08-20 CN disclosed
US-20040152740-A1 Arylglycine derivatives for use as glycine transport inhibitors NPS ALLELIX CORPORATION (CA) 2004-08-05 US disclosed
US-20040152741-A1 Arylglycine derivatives and their use as glycine transport inhibitors NPS ALLELIX CORPORATION (CA) 2004-08-05 US disclosed
WO-2004022528-A2 ARYLGLYCINE DERIVATIVES AND THEIR USE AS GLYCINE TRANSPORT INHIBITORS NPS ALLELIX CORP. (CA) 2004-03-18 WO disclosed
WO-2004022534-A1 ARYLGLYCINE DERIVATIVES FOR USE AS GLYCINE TRANSPORT INHIBITORS NPS ALLELIX CORP. (CA) 2004-03-18 WO disclosed
WO-2004022528-A2 ARYLGLYCINE DERIVATIVES AND THEIR USE AS GLYCINE TRANSPORT INHIBITORS NPS ALLELIX CORP. (CA) 2004-03-18 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 (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-20040152740-A1 Arylglycine derivatives for use as glycine transport inhibitors SLC1A2, SLC6A7, SLC1A1 NPC1 120/4885RAB9A 2094/4885MAPT 427/4885
US-20040152741-A1 Arylglycine derivatives and their use as glycine transport inhibitors SLC1A2, SLC1A1, SLC7A11 NPC1 119/4885RAB9A 1608/4885MAPT 694/4885

“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.