SCHEMBL9601567

SCHEMBL9601567

N#C/C=C\SCC1=C(C(=O)O)N2C(=O)C(NC(=O)C(=NOC(F)F)c3csc(NC(c4ccccc4)(c4ccccc4)c4ccccc4)n3)[C@@H]2SC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.46
▸ NR1I2 O75469 5/20 0.46
▸ HTR2C P28335 1/20 0.46
▸ PGR P06401 3/20 0.45
▸ MAPT P10636 4/20 0.44
▸ PPARG P37231 3/20 0.44
▸ SLC22A6 Q4U2R8 2/20 0.44
▸ SLC22A8 Q8TCC7 2/20 0.44
▸ SLC22A11 Q9NSA0 2/20 0.44
▸ ALB P02768 1/20 0.44
▸ DAO P14920 1/20 0.44
▸ SNCA P37840 1/20 0.44
▸ CYP2J2 P51589 1/20 0.44
▸ ABCC4 O15439 2/20 0.43
▸ APAF1 O14727 2/20 0.43
▸ PSMD14 O00487 1/20 0.43
▸ MMP2 P08253 1/20 0.43
▸ TDP1 Q9NUW8 6/20 0.42
▸ APEX1 P27695 2/20 0.42
▸ LMNA P02545 1/20 0.42

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
SCHEMBL9601560 1.00 KMT2A (0.46) KMT2ANR1I2HTR2CPGRMAPT
SCHEMBL9601807 0.93 KMT2A (0.40) KMT2ANR1I2HTR2CPGRMAPT
SCHEMBL9601802 0.93 KMT2A (0.40) KMT2ANR1I2HTR2CPGRMAPT
SCHEMBL9600120 0.87 NR1I2 (0.60) KMT2ANR1I2HTR2CPGRMAPT
SCHEMBL9600113 0.87 NR1I2 (0.60) KMT2ANR1I2HTR2CPGRMAPT
SCHEMBL9600004 0.87 NR1I2 (0.51) KMT2ANR1I2HTR2CPGRMAPT
SCHEMBL9599995 0.87 NR1I2 (0.51) KMT2ANR1I2HTR2CPGRMAPT
SCHEMBL9601915 0.86 NR1I2 (0.49) KMT2ANR1I2HTR2CPGRMAPT
SCHEMBL9601903 0.86 NR1I2 (0.49) KMT2ANR1I2HTR2CPGRMAPT
SCHEMBL9600718 0.85 NR1I2 (0.48) KMT2ANR1I2HTR2CPGRMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0188254-B1 CEPHEM COMPOUNDS, PROCESSES FOR PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-03-24 — — EP disclosed
US-4761410-A MICROBIOCIDE FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-08-02 — — US disclosed
EP-0188254-A2 Cephem compounds, processes for preparation thereof and pharmaceutical compositions containing them FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-07-23 — — EP disclosed
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