SCHEMBL6582258

SCHEMBL6582258

COC(=S)c1ccc(C)c(OC)c1C

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
MAPK1 P28482 1/20 0.33
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 3/20 0.30
KMT2A Q03164 3/20 0.30
MAPT P10636 3/20 0.30
ALDH1A1 P00352 3/20 0.30
PPARG P37231 1/20 0.30
NCOA2 Q15596 1/20 0.30
NCOA1 Q15788 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
NCOA3 Q9Y6Q9 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
HPGD P15428 1/20 0.30
RAD52 P43351 1/20 0.30
GAA P10253 1/20 0.30
RAB9A P51151 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
SCHEMBL8679253 0.81 ALDH1A1 (0.36) LMNAMAPK1KDM4EMEN1KMT2A
SCHEMBL6584600 0.78 ALDH1A1 (0.34) KDM4EALDH1A1HPGD
SCHEMBL9407109 0.77 LMNA (0.31) LMNASMN1; SMN2MAPK1
SCHEMBL11218412 0.74 TDP1 (0.50) LMNASMN1; SMN2MAPK1KDM4EMAPT
SCHEMBL30463491 0.73 ALDH1A1 (0.33) KDM4EMEN1KMT2AMAPTALDH1A1
SCHEMBL29051213 0.73 ALDH1A1 (0.33) KDM4EMEN1KMT2AMAPTALDH1A1
SCHEMBL27721374 0.72 ALDH1A1 (0.46) LMNAKDM4EMEN1KMT2AMAPT
SCHEMBL30968870 0.71 ALDH1A1 (0.39) LMNASMN1; SMN2MAPK1KDM4EMEN1
SCHEMBL146614 0.71 ALDH1A1 (0.39) LMNASMN1; SMN2MAPK1KDM4EMEN1
SCHEMBL6582254 0.70 SMN1; SMN2 (0.37) LMNASMN1; SMN2MAPK1KDM4EKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-5178818-A None JP disclosed
EP-0900795-B1 BENZENE DERIVATIVES SUBSTITUTED BY HETEROCYCLES AND HERBICIDES NIPPON SODA CO (JP) 2004-04-21 EP disclosed
US-6100421-A METHYL 3-FORMYL-4-METHANESULFONYL-2-METHYLBENZOATE, USEFUL AS A STARTING MATERIAL FOR HERBICIDE MANUFACTURE NIPPON SODA CO., LTD. (JP) 2000-08-08 US disclosed
US-5939360-A HERBICIDES WITH HYDROXYPYRAZOLEISOOXAZOLE KETONES NIPPON SODA CO., LTD. (JP) 1999-08-17 US disclosed
CN-1216543-A Heterocyclic substituted benzene derivatives and herbicides NIPPON SODA CO (JP) 1999-05-12 CN disclosed
EP-0900795-A1 BENZENE DERIVATIVES SUBSTITUTED BY HETEROCYCLES AND HERBICIDES NIPPON SODA CO., LTD. (JP) 1999-03-10 EP disclosed
EP-0894792-A1 HETEROCYCLE-SUBSTITUTED BENZENE DERIVATIVES AND HERBICIDES NIPPON SODA CO., LTD. (JP) 1999-02-03 EP disclosed
JP-H05178818-A SUBSTITUTED BENZOIC ACID ESTER AND ITS PRODUCTION NIPPON SODA CO LTD 1993-07-20 JP disclosed