SCHEMBL2456530

SCHEMBL2456530

CCCON=C(C(=O)O)c1csc(N)n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.52
MEN1 O00255 2/20 0.52
ALDH1A1 P00352 2/20 0.52
KMT2A Q03164 2/20 0.52
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
ITGB1 P05556 1/20 0.43
ITGA4 P13612 1/20 0.43
LMNA P02545 3/20 0.41
GAA P10253 1/20 0.41
TDP1 Q9NUW8 3/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
MAPK1 P28482 1/20 0.41
GABRA5 P31644 1/20 0.38
GABRB2 P47870 1/20 0.38
HSD17B10 Q99714 1/20 0.38
USP2 O75604 1/20 0.37
ESR1 P03372 1/20 0.37
KDM4E B2RXH2 1/20 0.37
TSHR P16473 2/20 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
SCHEMBL11107596 1.00 MAPT (0.52) MAPTMEN1ALDH1A1KMT2ANPC1
SCHEMBL9691586 1.00 MAPT (0.52) MAPTMEN1ALDH1A1KMT2ANPC1
SCHEMBL9692534 0.92 MAPT (0.50) MAPTMEN1ALDH1A1KMT2ANPC1
SCHEMBL8644758 0.92 MAPT (0.50) MAPTMEN1ALDH1A1KMT2ANPC1
SCHEMBL11012592 0.91 ITGB1 (0.50) MAPTMEN1ALDH1A1KMT2ANPC1
SCHEMBL10418465 0.91 ITGB1 (0.50) MAPTMEN1ALDH1A1KMT2ANPC1
SCHEMBL10418464 0.91 ITGB1 (0.50) MAPTMEN1ALDH1A1KMT2ANPC1
SCHEMBL10418049 0.90 ITGB1 (0.49) MAPTMEN1ALDH1A1KMT2ANPC1
SCHEMBL9691582 0.90 ITGB1 (0.49) MAPTMEN1ALDH1A1KMT2ANPC1
SCHEMBL10418050 0.90 ITGB1 (0.49) MAPTMEN1ALDH1A1KMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8445476-B2 Carbacephem β-lactam antibiotics ACHAOGEN, INC. (US) 2013-05-21 US disclosed
US-20110224186-A1 CARBACEPHEM BETA-LACTAM ANTIBIOTICS ACHAOGEN, INC. (US) 2011-09-15 US disclosed
WO-2010123997-A1 CARBACEPHEM BETA-LACTAM ANTIBIOTICS ACHAOGEN, INC. (US) 2010-10-28 WO disclosed
US-20100267686-A1 CARBACEPHEM BETA-LACTAM ANTIBIOTICS ACHAOGEN, INC. (US) 2010-10-21 US disclosed
EP-2205600-A1 CARBACEPHEM ß -LACTAM ANTIBIOTICS Achaogen, Inc. (US) 2010-07-14 EP disclosed
WO-2010030810-A1 CARBACEPHEM BETA-LACTAM ANTIBIOTICS ACHAOGEN, INC. (US) 2010-03-18 WO disclosed
WO-2010030811-A2 CARBACEPHEM β-LACTAM ANTIBIOTICS ACHAOGEN, INC. (US) 2010-03-18 WO disclosed
WO-2009055696-A1 CARBACEPHEM β-LACTAM ANTIBIOTICS ACHAOGEN, INC. (US) 2009-04-30 WO disclosed
US-6927290-B2 Production of mixed acid anhydride and amide compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-08-09 US disclosed
US-20040210059-A1 Production of mixed acid anhydride and amide compound SUMITOMO CHEMICAL COMPANY, LIMITED 2004-10-21 US disclosed
EP-0095778-A1 2-Oxo-1-azetidinesulfonic acid derivatives, process for production thereof, and use thereof BANYU PHARMACEUTICAL CO., LTD. (JP) 1983-12-07 EP disclosed
US-4411898-A CEPHALOSPORIN ANTIBACTERIAL AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-10-25 US disclosed
US-4400379-A ANTIBIOTICS FUJISAWA PHARMACEUTICAL COMPANY, LIMITED (JP) 1983-08-23 US disclosed
US-4399133-A ADMINISTERING, INFECTIONS FUJISAWA PHARMACEUTICAL COMPANY, LIMITED (JP) 1983-08-16 US disclosed
US-4393059-A BACTERICIDAL CEPHALOSPORINS FUJISAWA PHARMACEUTICAL COMPANY, LIMITED (JP) 1983-07-12 US disclosed
US-4367228-A BACTERICIDES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-01-04 US disclosed
US-4331664-A BACTERIOSTATS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1982-05-25 US disclosed
US-4294960-A 7-[2-(2-Aminothiazol-4-yl)-2-cyclopentyloxyiminoacetamido]-3-cephem-4-carboxylic acid (synisomer) FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1981-10-13 US disclosed
US-4288436-A ANTIBIOTICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1981-09-08 US disclosed
US-4196205-A ANTIBIOTICS, BACTERICIDES ROUSSEL UCLAF (FR) 1980-04-01 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 (3 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-20110224186-A1 CARBACEPHEM BETA-LACTAM ANTIBIOTICS MGAM, MGAM2, B2M MAPT 3937/4885MEN1 2327/4885ALDH1A1 2455/4885
US-20100267686-A1 CARBACEPHEM BETA-LACTAM ANTIBIOTICS MGAM, MGAM2, B2M MAPT 3888/4885MEN1 2194/4885ALDH1A1 2468/4885
US-20040210059-A1 Production of mixed acid anhydride and amide compound CA2, CA1, CA3 MAPT 4620/4885MEN1 2071/4885ALDH1A1 543/4885

“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.