SCHEMBL10367139

SCHEMBL10367139

C#CC1=C(C(=O)OC(c2ccccc2)c2ccccc2)N2C(=O)C(NC(=O)/C(=N\OCC)c3nsc(N)n3)[C@H]2SC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 1/20 0.54
▸ TDP1 Q9NUW8 5/20 0.40
▸ APAF1 O14727 2/20 0.40
▸ LMNA P02545 2/20 0.40
▸ TSHR P16473 1/20 0.40
▸ APEX1 P27695 1/20 0.40
▸ PLCG1 P19174 1/20 0.40
▸ ABCC2 Q92887 1/20 0.40
▸ SIRT5 Q9NXA8 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ PSMD14 O00487 1/20 0.40
▸ MMP2 P08253 1/20 0.40
▸ NR1I2 O75469 3/20 0.39
▸ HTR2C P28335 1/20 0.39
▸ PTGS1 P23219 2/20 0.39
▸ ABCB11 O95342 1/20 0.39
▸ PDE4D Q08499 1/20 0.39
▸ MAPT P10636 5/20 0.38
▸ ALDH1A1 P00352 5/20 0.38
▸ KMT2A Q03164 4/20 0.38

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
SCHEMBL10672527 1.00 KCNH2 (0.54) KCNH2TDP1APAF1LMNATSHR
SCHEMBL9624450 0.89 KCNH2 (0.55) KCNH2TDP1APAF1LMNATSHR
SCHEMBL4337797 0.89 KCNH2 (0.55) KCNH2TDP1APAF1LMNATSHR
SCHEMBL10504227 0.89 KCNH2 (0.55) KCNH2TDP1APAF1LMNATSHR
SCHEMBL10532770 0.89 KCNH2 (0.55) KCNH2TDP1APAF1LMNATSHR
SCHEMBL9624448 0.89 KCNH2 (0.55) KCNH2TDP1APAF1LMNATSHR
SCHEMBL10504223 0.89 KCNH2 (0.55) KCNH2TDP1APAF1LMNATSHR
SCHEMBL4337805 0.89 KCNH2 (0.55) KCNH2TDP1APAF1LMNATSHR
SCHEMBL10528896 0.88 KCNH2 (0.56) KCNH2TDP1APAF1LMNATSHR
SCHEMBL10528910 0.88 KCNH2 (0.56) KCNH2TDP1APAF1LMNATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0111281-B1 NEW CEPHEM COMPOUNDS AND PROCESSES FOR PREPARATION THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1990-06-06 — — EP disclosed
US-4719206-A ANTIBIOTICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-01-12 — — US disclosed
US-4584290-A MICROBIOCIDES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-04-22 — — US disclosed
EP-0111281-A2 New cephem compounds and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-06-20 — — EP disclosed
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