SCHEMBL10418633

SCHEMBL10418633

CO/N=C(\C(=O)NC1C(=O)N2C(C(=O)O)=C(Cl)CS[C@H]12)c1csc(N)n1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR1I2 O75469 6/20 0.78
▸ HTR2C P28335 1/20 0.78
▸ MAPT P10636 3/20 0.75
▸ PPARG P37231 2/20 0.75
▸ SLC22A6 Q4U2R8 2/20 0.75
▸ SLC22A8 Q8TCC7 2/20 0.75
▸ SLC22A11 Q9NSA0 2/20 0.75
▸ ALB P02768 1/20 0.75
▸ PGR P06401 3/20 0.71
▸ PTGS2 P35354 1/20 0.71
▸ TDP1 Q9NUW8 5/20 0.66
▸ APEX1 P27695 3/20 0.66
▸ ABCC4 O15439 3/20 0.66
▸ LMNA P02545 2/20 0.66
▸ L3MBTL1 Q9Y468 2/20 0.66
▸ CYP1A2 P05177 1/20 0.66
▸ PKM P14618 1/20 0.66
▸ HSD17B10 Q99714 1/20 0.66
▸ ALDH1A1 P00352 1/20 0.66
▸ POLB P06746 1/20 0.66

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
SCHEMBL10418637 1.00 NR1I2 (0.78) NR1I2HTR2CMAPTPPARGSLC22A6
SCHEMBL10535346 1.00 NR1I2 (0.78) NR1I2HTR2CMAPTPPARGSLC22A6
SCHEMBL11217052 0.99 NR1I2 (0.77) NR1I2HTR2CMAPTPPARGSLC22A6
Hydrochloric Acid SCHEMBL10417892 0.99 NR1I2 (0.77) NR1I2HTR2CMAPTPPARGSLC22A6
Hydrochloric Acid SCHEMBL10417890 0.99 NR1I2 (0.77) NR1I2HTR2CMAPTPPARGSLC22A6
SCHEMBL11151304 0.92 TDP1 (0.75) NR1I2HTR2CMAPTPPARGSLC22A6
SCHEMBL11151291 0.92 TDP1 (0.75) NR1I2HTR2CMAPTPPARGSLC22A6
SCHEMBL10418935 0.92 TDP1 (0.69) NR1I2HTR2CMAPTPPARGSLC22A6
SCHEMBL10418936 0.92 TDP1 (0.69) NR1I2HTR2CMAPTPPARGSLC22A6
Water SCHEMBL11141115 0.91 TDP1 (0.74) NR1I2HTR2CMAPTPPARGSLC22A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4380541-A 2-AMINO THIAZOL-4-YL- TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1983-04-19 — — US claimed
US-4923998-A ANTIBIOTICS FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) 1990-05-08 — — US disclosed
US-4841062-A CHEMICAL INTERMEDIATES FUJISAWA PHARMACEUTICAL COMPANY, LIMITED (JP) 1989-06-20 — — US disclosed
US-4822888-A INTERMEDIATES FOR CEPHALOSPORIN ANTIBIOTICS FUJISAWA PHARMACEUTICAL COMPANY, LIMITED (JP) 1989-04-18 — — US disclosed
US-4604456-A BACTERICIDES, ANTIBIOTICS FUJISAWA PHARMACEUTICAL COMPANY, LIMITED (JP) 1986-08-05 — — US disclosed
US-4563522-A BACTERICIDAL ANTIBIOTICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-01-07 — — US disclosed
US-4460583-A ANTIBIOTIC, BACTERICIDE FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-07-17 — — US disclosed
US-4447430-A BACTERICIDES, ANTIBIOTICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-05-08 — — US disclosed
US-4427674-A Cephem compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-01-24 — — US disclosed
US-4425341-A CEPHALOSPORING FUJISAWA PHARMACEUTICAL COMPANY, LIMITED (JP) 1984-01-10 — — 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-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
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