SCHEMBL4797356

SCHEMBL4797356

O=C(CCl)Nc1n[c]cs1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
CGAS Q8N884 1/20 0.40
LMNA P02545 4/20 0.38
KDM4E B2RXH2 3/20 0.38
NPC1 O15118 3/20 0.38
MITF O75030 3/20 0.38
RAB9A P51151 3/20 0.38
CASP2 P42575 2/20 0.38
EGFR P00533 1/20 0.38
GAA P10253 1/20 0.38
THRB P10828 1/20 0.38
MAPK1 P28482 1/20 0.38
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
BLM P54132 1/20 0.38
KMT2A Q03164 1/20 0.38
CASP3 P42574 1/20 0.37

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
SCHEMBL4811290 0.85 CSNK2A2 (0.39) ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL4813580 0.80 MAPT (0.48) ALDH1A1MAPK1MAPTL3MBTL1
SCHEMBL9481584 0.73 MEN1 (0.39) ALDH1A1NPC1RAB9AMEN1POLB
SCHEMBL1970389 0.70 POLB (0.56) ALDH1A1SMN1; SMN2LMNAKDM4EGAA
SCHEMBL1358344 0.70 ACP1 (0.63) SMN1; SMN2LMNANPC1RAB9ATHRB
SCHEMBL5912479 0.70 NPC1 (0.55) ALDH1A1SMN1; SMN2LMNAKDM4ENPC1
SCHEMBL7093176 0.69 NPC1 (0.58) ALDH1A1SMN1; SMN2LMNAKDM4ENPC1
SCHEMBL11595205 0.69 CGAS (0.48) ALDH1A1SMN1; SMN2CGASLMNAKDM4E
SCHEMBL1358076 0.68 CGAS (0.47) ALDH1A1SMN1; SMN2CGASLMNANPC1
SCHEMBL1358356 0.68 SMN1; SMN2 (0.61) ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A

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 65 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0354757-A2 Cephalosporins and homologous compounds, process for their preparation and pharmaceutical compositions containing them BEECHAM GROUP PLC (GB) 1990-02-14 EP claimed
EP-0265185-A2 Cephalosporins, processes for their preparation and pharmaceutical compositions containing them BEECHAM GROUP PLC (GB) 1988-04-27 EP claimed
US-4490524-A BACTERICIDES TOYO JOZO KABUSHIKI KAISHA (JP) 1984-12-25 US claimed
US-7355040-B2 Process for the preparation of cephalosporin compounds and synthetic intermediates ZOETIS SERVICES LLC 2008-04-08 US disclosed
EP-1178049-B1 Process for the preparation of cephalosporin compounds and intermediates for the synthesis of these compounds PFIZER (US) 2005-12-28 EP disclosed
US-20050165229-A1 Novel process PFIZER, INC. (US) 2005-07-28 US disclosed
US-6825344-B2 CYCLIZATION CEPHAM DERIVATIVE PFIZER INC. 2004-11-30 US disclosed
US-20020058806-A1 Novel process ZOETIS SERVICES LLC 2002-05-16 US disclosed
EP-1178049-A1 Process for the preparation of cephalosporin compounds and intermediates for the synthesis of these compounds PFIZER INC. (US) 2002-02-06 EP disclosed
EP-0624160-B1 2-ISOCEPHEM AND OXACEPHEM DERIVATIVES, PROCESSES FOR THEIR PREPARATION, INTERMEDIATES THEREOF AND USE AS ANTIBACTERIAL AGENTS PFIZER (US) 2001-10-31 EP disclosed
EP-0625984-B1 CEPHALOSPORIN COMPOUNDS PFIZER (US) 2001-08-01 EP disclosed
EP-0367124-A1 Penicillanic acid derivatives F. HOFFMANN-LA ROCHE AG (CH) 1990-05-09 EP disclosed
EP-0359536-A2 Cephalosporin compounds, process for their preparation and pharmaceutical compositions BEECHAM GROUP PLC (GB) 1990-03-21 EP disclosed
EP-0354757-A2 Cephalosporins and homologous compounds, process for their preparation and pharmaceutical compositions containing them BEECHAM GROUP PLC (GB) 1990-02-14 EP disclosed
US-4771045-A 2-oxozetidinone derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1988-09-13 US disclosed
EP-0265185-A2 Cephalosporins, processes for their preparation and pharmaceutical compositions containing them BEECHAM GROUP PLC (GB) 1988-04-27 EP disclosed
CN-85105120-A The preparation method of novel cephalosporin derivatives 1986-12-31 CN disclosed
CN-85105797-A The preparation of antimicrobial compounds 1986-08-27 CN disclosed
US-4490524-A BACTERICIDES TOYO JOZO KABUSHIKI KAISHA (JP) 1984-12-25 US disclosed
US-4490524-A BACTERICIDES TOYO JOZO KABUSHIKI KAISHA (JP) 1984-12-25 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 (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-20050165229-A1 Novel process CYP11B2, CCNB1, CYP11B1 ALDH1A1 1333/4885SMN1; SMN2 2262/4885CGAS 1242/4885
US-20020058806-A1 Novel process CYP4B1, CYP11B2, CYP11B1 ALDH1A1 1283/4885SMN1; SMN2 1611/4885CGAS 2315/4885

“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.