SCHEMBL9040451

SCHEMBL9040451

Cc1cc(C#N)n(-c2ccc(CO)cc2)c1C

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
VHL P40337 1/20 0.37
ELOC Q15369 1/20 0.37
ELOB Q15370 1/20 0.37
LMNA P02545 1/20 0.35
KDM4E B2RXH2 2/20 0.33
CHKA P35790 1/20 0.33
MAPT P10636 1/20 0.33
USP14 P54578 6/20 0.33
KLKB1 P03952 1/20 0.33
CTSB P07858 1/20 0.33
AR P10275 3/20 0.32
ALDH1A1 P00352 1/20 0.32
PDCD1 Q15116 1/20 0.31
CD274 Q9NZQ7 1/20 0.31
TSHR P16473 1/20 0.31

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
SCHEMBL9039687 0.84 VHL (0.35) VHLELOCELOBMAPTUSP14
SCHEMBL9041924 0.84 VHL (0.35) VHLELOCELOBLMNAKDM4E
SCHEMBL9043581 0.84 VHL (0.35) VHLELOCELOBLMNAKDM4E
SCHEMBL7007409 0.77 CTSB (0.45) VHLELOCELOBLMNAKDM4E
SCHEMBL27352292 0.75 PTPN1 (0.32) LMNA
SCHEMBL9042491 0.73 COMT (0.36) VHLELOCELOBLMNAKDM4E
SCHEMBL9171948 0.72 TSHR (0.40) VHLELOCELOBALDH1A1PDCD1
SCHEMBL9042863 0.70 VHL (0.36) VHLELOCELOBCHKAALDH1A1
SCHEMBL9587506 0.67 COMT (0.38) VHLELOCELOBCHKA
SCHEMBL9588003 0.67 VHL (0.47) VHLELOCELOBLMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0480204-B1 Imidazole derivatives, potent and selective antagonists of angiotensin II receptor FUJISAWA PHARMACEUTICAL CO (JP) 1996-03-20 EP disclosed
US-5215994-A Treating or preventing hypertension or heart failure FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-06-01 US disclosed
US-5210092-A Hypotensive agents FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-05-11 US disclosed
EP-0480204-A1 Imidazole derivatives, potent and selective antagonists of angiotensin II receptor FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-04-15 EP disclosed
CN-1059723-A Hete rocyclic derivatives FUJISAWA PHARMACEUTICAL CO (JP) 1992-03-25 CN disclosed