SCHEMBL10905331

SCHEMBL10905331

Cc1ccc(S(=O)(=O)O)cc1.Cc1ccc(S(=O)(=O)O)cc1C

nearest known ligand 0.53

Known targets — ChEMBL curated mechanism

ABL1BMXBRAFBTKCHRNA4CHRNB2CSNK1EEGFRERBB2F10FLT1FLT3FLT4IGF1RINSRITKJAK3KDRKITOPRM1PARP1PARP2PDGFRBPIK3CDRAF1RETSLC18A2TECTXKdacAdacBdacCftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.53
▸ TDP1 Q9NUW8 2/20 0.53
▸ SNCA P37840 1/20 0.53
▸ ALDH1A1 P00352 6/20 0.47
▸ HTT P42858 2/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ PKM P14618 2/20 0.47
▸ GAA P10253 2/20 0.46
▸ RAPGEF4 Q8WZA2 1/20 0.46
▸ GFER P55789 1/20 0.44
▸ CA1 P00915 2/20 0.44
▸ CA2 P00918 2/20 0.44
▸ MMP1 P03956 1/20 0.44
▸ MMP2 P08253 1/20 0.44
▸ MMP9 P14780 1/20 0.44
▸ MMP8 P22894 1/20 0.44
▸ MMP13 P45452 1/20 0.44

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
SCHEMBL30487906 0.92 LMNA (0.61) LMNATDP1SNCAALDH1A1HTT
SCHEMBL83885 0.92 LMNA (0.61) LMNATDP1SNCAALDH1A1HTT
SCHEMBL8715253 0.90 LMNA (0.59) LMNATDP1SNCAALDH1A1HTT
SCHEMBL7022903 0.90 LMNA (0.59) LMNATDP1SNCAALDH1A1HTT
SCHEMBL6913755 0.90 LMNA (0.59) LMNATDP1SNCAALDH1A1HTT
SCHEMBL8715228 0.90 LMNA (0.59) LMNATDP1SNCAALDH1A1HTT
Water SCHEMBL11029598 0.90 LMNA (0.59) LMNATDP1SNCAALDH1A1HTT
SCHEMBL6908458 0.90 LMNA (0.59) LMNATDP1SNCAALDH1A1HTT
SCHEMBL6916815 0.90 LMNA (0.59) LMNATDP1SNCAALDH1A1HTT
SCHEMBL6912903 0.90 LMNA (0.59) LMNATDP1SNCAALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4624975-A Process for stabilizing the hydrolyzable chloride content in epoxy resins THE DOW CHEMICAL COMPANY (US) 1986-11-25 — — US disclosed
Send feedback