SCHEMBL7770536

SCHEMBL7770536

C=CC1=C(C(=O)O)N2C(=O)[C@@H](NC(=O)/C(=N\O)c3nc(N)sc3Cl)[C@H]2SC1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 5/20 0.70
MAPT P10636 3/20 0.70
ABCC4 O15439 1/20 0.70
CNR1 P21554 1/20 0.70
CTDSP1 Q9GZU7 1/20 0.70
APAF1 O14727 2/20 0.58
LMNA P02545 1/20 0.58
TSHR P16473 1/20 0.58
APEX1 P27695 1/20 0.58
PLCG1 P19174 1/20 0.58
ABCC2 Q92887 1/20 0.58
SIRT5 Q9NXA8 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
HPGD P15428 1/20 0.57
PSMD14 O00487 1/20 0.57
MMP2 P08253 1/20 0.57
POLB P06746 1/20 0.49
PKM P14618 1/20 0.49
HTT P42858 1/20 0.49
DUSP3 P51452 1/20 0.49

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
SCHEMBL8169558 1.00 TDP1 (0.70) TDP1MAPTABCC4CNR1CTDSP1
SCHEMBL9481589 0.89 TDP1 (0.72) TDP1MAPTABCC4CNR1CTDSP1
SCHEMBL9481568 0.89 TDP1 (0.72) TDP1MAPTABCC4CNR1CTDSP1
SCHEMBL9482446 0.87 TDP1 (0.56) TDP1MAPTABCC4CNR1CTDSP1
SCHEMBL9482431 0.87 TDP1 (0.56) TDP1MAPTABCC4CNR1CTDSP1
SCHEMBL7766669 0.85 TDP1 (0.52) TDP1MAPTABCC4CNR1CTDSP1
SCHEMBL7766665 0.85 TDP1 (0.52) TDP1MAPTABCC4CNR1CTDSP1
SCHEMBL9481007 0.84 TDP1 (0.60) TDP1MAPTABCC4CNR1CTDSP1
SCHEMBL9481004 0.84 TDP1 (0.60) TDP1MAPTABCC4CNR1CTDSP1
SCHEMBL9482639 0.84 TDP1 (0.52) TDP1MAPTABCC4CNR1CTDSP1

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-0854875-B1 NEW CEPHEM COMPOUNDS FUJISAWA PHARMACEUTICAL CO (JP) 2001-06-13 EP disclosed
US-6159961-A Cephem compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-12-12 US disclosed