SCHEMBL17255683

SCHEMBL17255683

Cc1cc(C)n(-c2cc(Cl)ccc2O)n1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.66
GAA P10253 1/20 0.66
MAPK1 P28482 2/20 0.45
ALDH1A1 P00352 2/20 0.45
TSHR P16473 1/20 0.45
IDO1 P14902 1/20 0.44
MAPT P10636 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
KCNN3 Q9UGI6 1/20 0.43
ENPP3 O14638 1/20 0.43
ALPL P05186 1/20 0.43
XIAP P98170 1/20 0.43
HTT P42858 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MEN1 O00255 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL17255695 0.87 KDM4E (0.66) KDM4EGAAMAPK1ALDH1A1TSHR
SCHEMBL28171784 0.83 KDM4E (0.51) KDM4EGAAALDH1A1TSHRMAPT
SCHEMBL15443102 0.83 KDM4E (0.70) KDM4EGAAALDH1A1TSHRMAPT
SCHEMBL15330995 0.81 KDM4E (0.49) KDM4EGAAMAPK1ALDH1A1TSHR
SCHEMBL17255680 0.80 KDM4E (0.66) KDM4EGAAMAPK1TSHRMAPT
SCHEMBL3685546 0.79 KDM4E (0.51) KDM4EGAATSHRMAPTNPC1
SCHEMBL15442925 0.78 POLB (0.49) KDM4EGAAMAPK1ALDH1A1TSHR
SCHEMBL2052349 0.77 KDM4E (0.67) KDM4EGAAMAPK1ALDH1A1TSHR
SCHEMBL15442244 0.77 KDM4E (0.85) KDM4EGAAALDH1A1TSHRMAPT
SCHEMBL15443120 0.77 KDM4E (0.71) KDM4EGAAALDH1A1TSHRMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2669274-B1 TOPICAL ANTIFUNGAL AGENT MEIJI SEIKA PHARMA CO LTD (JP) 2015-11-18 EP claimed
CN-103339112-A Topical antifungal agent MEIJI SEIKA PHARMA CO LTD 2013-10-02 CN claimed
CN-103339112-A Topical antifungal agent MEIJI SEIKA PHARMA CO LTD 2013-10-02 CN disclosed