SCHEMBL9196285

SCHEMBL9196285

c1cc2c(ccc3sccc32)nn1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.37
MAPT P10636 3/20 0.37
ALDH1A1 P00352 2/20 0.37
HTT P42858 2/20 0.37
HPGD P15428 1/20 0.37
PPARG P37231 1/20 0.37
NCOA2 Q15596 1/20 0.37
NCOA1 Q15788 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
NCOA3 Q9Y6Q9 1/20 0.37
LMNA P02545 1/20 0.36
PKM P14618 1/20 0.36
HTR2C P28335 1/20 0.32
GAA P10253 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
SCHEMBL2498909 0.73 KDM4E (0.45) KDM4EMAPTALDH1A1HTTHPGD
SCHEMBL29352476 0.73 KDM4E (0.45) KDM4EMAPTALDH1A1HTTHPGD
SCHEMBL218043 0.73
SCHEMBL7289957 0.72 HTR2C (0.33) KDM4EMAPTLMNAHTR2C
SCHEMBL31514293 0.71 ALDH1A1 (0.32) ALDH1A1
Bromide SCHEMBL29671076 0.71 ALDH1A1 (0.32) ALDH1A1
Hydrochloric Acid SCHEMBL29671085 0.71 ALDH1A1 (0.32) ALDH1A1
SCHEMBL12278092 0.69 KDM4E (0.42) KDM4EMAPTALDH1A1HTTHPGD
SCHEMBL20182388 0.69 KDM4E (0.42) KDM4EMAPTALDH1A1HTTHPGD
SCHEMBL2368365 0.69 KDM4E (0.42) KDM4EMAPTALDH1A1HTTHPGD

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-0487768-B1 Pharmaceutical composition with improved dissolution property YOSHITOMI PHARMACEUTICAL (JP) 1995-01-25 EP claimed
EP-0487768-A1 Pharmaceutical composition with improved dissolution property YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1992-06-03 EP claimed
JP-6016556-A None JP disclosed
JP-H0616556-A SLIGHTLY SOLUBLE MEDICINE-CONTAINING PREPARATION YOSHITOMI PHARMACEUT IND LTD 1994-01-25 JP disclosed