SCHEMBL8308058

SCHEMBL8308058

Cc1c(Br)cc(Cl)c2c1C(=O)CCS2

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
VHL P40337 1/20 0.34
ELOC Q15369 1/20 0.34
ELOB Q15370 1/20 0.34
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
SIRT2 Q8IXJ6 1/20 0.30

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
SCHEMBL8346362 0.84 VHL (0.36) VHLELOCELOB
SCHEMBL6725377 0.84 ALDH1A1 (0.32) KDM4EALDH1A1
SCHEMBL8128418 0.78 KDM4E (0.33) VHLELOCELOBKDM4EALDH1A1
SCHEMBL8549149 0.76
SCHEMBL8549146 0.76
SCHEMBL31028896 0.76 VHL (0.37) VHLELOCELOBKDM4E
SCHEMBL6732015 0.73 BAZ2B (0.41) KDM4EALDH1A1
SCHEMBL25783984 0.72 VHL (0.37) VHLELOCELOBKDM4EALDH1A1
SCHEMBL8346491 0.71 VHL (0.41) VHLELOCELOBKDM4EALDH1A1
SCHEMBL91636 0.69 CES1 (0.38) VHLELOCELOBKDM4EALDH1A1

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-0629623-B1 PYRAZOLE DERIVATIVE IDEMITSU KOSAN CO (JP) 1999-05-19 EP disclosed
EP-0818455-A1 PYRAZOLE DERIVATIVES IDEMITSU KOSAN COMPANY LIMITED (JP) 1998-01-14 EP disclosed
US-5587484-A HALOGENATION; OXIDATION; SULFONATION; HERBICIDES IDEMITSU KOSAN CO., LTD. (JP) 1996-12-24 US disclosed
US-5468722-A Herbicides for corn, wheat, barley IDEMITSU KOSAN CO., LTD. (JP) 1995-11-21 US disclosed
EP-0629623-A1 PYRAZOLE DERIVATIVE IDEMITSU KOSAN COMPANY LIMITED (JP) 1994-12-21 EP disclosed