SCHEMBL10760955

SCHEMBL10760955

Nc1nc(C(=NO)C(=O)NC2C(=O)N3C(C(=O)O)=C(CSc4ncns4)CS[C@@H]23)cs1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 7/20 0.64
▸ MAPT P10636 5/20 0.64
▸ ABCC4 O15439 2/20 0.64
▸ CNR1 P21554 1/20 0.64
▸ CTDSP1 Q9GZU7 1/20 0.64
▸ NR1I2 O75469 4/20 0.61
▸ PGR P06401 2/20 0.61
▸ HTR2C P28335 1/20 0.60
▸ PPARG P37231 2/20 0.60
▸ SLC22A6 Q4U2R8 2/20 0.60
▸ SLC22A8 Q8TCC7 2/20 0.60
▸ SLC22A11 Q9NSA0 2/20 0.60
▸ DAO P14920 1/20 0.60
▸ SNCA P37840 1/20 0.60
▸ CYP2J2 P51589 1/20 0.60
▸ ALB P02768 1/20 0.58
▸ KMT2A Q03164 1/20 0.56
▸ APEX1 P27695 3/20 0.54
▸ APAF1 O14727 2/20 0.54
▸ LMNA P02545 1/20 0.54

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
SCHEMBL29390470 1.00 TDP1 (0.64) TDP1MAPTABCC4CNR1CTDSP1
SCHEMBL10760946 1.00 TDP1 (0.64) TDP1MAPTABCC4CNR1CTDSP1
Hydrochloric Acid SCHEMBL10765031 0.99 TDP1 (0.63) TDP1MAPTABCC4CNR1CTDSP1
Hydrochloric Acid SCHEMBL10765024 0.99 TDP1 (0.63) TDP1MAPTABCC4CNR1CTDSP1
Sulfuric Acid SCHEMBL10762581 0.98 TDP1 (0.61) TDP1MAPTABCC4CNR1CTDSP1
Sulfuric Acid SCHEMBL10762570 0.98 TDP1 (0.61) TDP1MAPTABCC4CNR1CTDSP1
SCHEMBL10763889 0.93 TDP1 (0.61) TDP1MAPTABCC4CNR1CTDSP1
SCHEMBL10763878 0.93 TDP1 (0.61) TDP1MAPTABCC4CNR1CTDSP1
SCHEMBL10759802 0.90 NR1I2 (0.66) TDP1MAPTABCC4NR1I2PGR
SCHEMBL10824966 0.90 NR1I2 (0.64) TDP1MAPTABCC4NR1I2PGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0214462-A2 3,7-Disubstituted-3-cephem compounds and processes for production of the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-03-18 — — EP claimed
EP-0214462-A2 3,7-Disubstituted-3-cephem compounds and processes for production of the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-03-18 — — EP disclosed
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