SCHEMBL15422769

SCHEMBL15422769

CC(=O)NC[C@@H](CCl)OC(=O)OCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.47
MTNR1A P48039 3/20 0.46
MTNR1B P49286 3/20 0.46
KMT2A Q03164 2/20 0.43
SLC6A2 P23975 1/20 0.43
SLC6A3 Q01959 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
HTT P42858 1/20 0.42
LMNA P02545 3/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
RAB9A P51151 1/20 0.40
MEN1 O00255 1/20 0.40
MAPK1 P28482 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
SYK P43405 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
SCHEMBL15422770 1.00 ALDH1A1 (0.47) ALDH1A1MTNR1AMTNR1BKMT2ASLC6A2
SCHEMBL6153937 0.83 ALDH1A1 (0.50) ALDH1A1HTTLMNASMN1; SMN2RAB9A
SCHEMBL6153940 0.83 ALDH1A1 (0.50) ALDH1A1HTTLMNASMN1; SMN2RAB9A
SCHEMBL6154638 0.83 ALDH1A1 (0.50) ALDH1A1HTTLMNASMN1; SMN2RAB9A
SCHEMBL14830272 0.81 MTNR1A (0.52) ALDH1A1MTNR1AMTNR1BL3MBTL1
SCHEMBL14830271 0.81 MTNR1A (0.52) ALDH1A1MTNR1AMTNR1BL3MBTL1
SCHEMBL6153903 0.77 SLC6A2 (0.53) ALDH1A1KMT2ASLC6A2SLC6A3TDP1
SCHEMBL6153899 0.77 SLC6A2 (0.53) ALDH1A1KMT2ASLC6A2SLC6A3TDP1
SCHEMBL15422310 0.76 ALDH1A1 (0.40) ALDH1A1MTNR1AMTNR1BHTTLMNA
SCHEMBL15422311 0.76 ALDH1A1 (0.40) ALDH1A1MTNR1AMTNR1BHTTLMNA

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
EP-3095777-B1 LINEZOLID INTERMEDIATE AND METHOD FOR SYNTHESIZING LINEZOLID ZHEJIANG MED XINCHANG PHARM (CN) 2018-06-27 EP disclosed
EP-3095777-A1 LINEZOLID INTERMEDIATE AND METHOD FOR SYNTHESIZING LINEZOLID ZheJiang Medicine Co., Ltd. Xinchang Pharmaceutical Factory (CN) 2016-11-23 EP disclosed
US-8962827-B2 Linezolid intermediate and method for synthesizing linezolid ZHEJIANG MEDICINE CO. LTD. XINCHANG PHARMACEUTICAL FACTORY (CN) 2015-02-24 US disclosed
US-8962827-B2 Linezolid intermediate and method for synthesizing linezolid ZHEJIANG MEDICINE CO. LTD. XINCHANG PHARMACEUTICAL FACTORY (CN) 2015-02-24 US disclosed
US-20140024827-A1 LINEZOLID INTERMEDIATE AND METHOD FOR SYNTHESIZING LINEZOLID ZHEJIANG MEDICINE CO., LTD XINCHANG PHARMACEUTICAL FACTORY (CN) 2014-01-23 US disclosed
US-20140024827-A1 LINEZOLID INTERMEDIATE AND METHOD FOR SYNTHESIZING LINEZOLID ZHEJIANG MEDICINE CO., LTD XINCHANG PHARMACEUTICAL FACTORY (CN) 2014-01-23 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-20140024827-A1 LINEZOLID INTERMEDIATE AND METHOD FOR SYNTHESIZING LINEZOLID CYP2C9, CYP3A4, CYP2C19 ALDH1A1 613/4885MTNR1A 4042/4885MTNR1B 3967/4885

“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.