SCHEMBL9713604

SCHEMBL9713604

O=C1C(Cl)=CC(=O)c2c(Sc3ccc(F)cc3)cccc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.48
KDM4E B2RXH2 1/20 0.48
NSD2 O96028 1/20 0.48
MAPK1 P28482 1/20 0.48
P4HB P07237 4/20 0.47
AURKA O14965 1/20 0.40
AURKB Q96GD4 1/20 0.40
PTPN1 P18031 1/20 0.38
CDC25A P30304 1/20 0.38
CDC25B P30305 1/20 0.38
RHEB Q15382 2/20 0.37
DHFR P00374 1/20 0.35
MAPK13 O15264 1/20 0.33
MAPK12 P53778 1/20 0.33
MAPK11 Q15759 1/20 0.33
MAPK14 Q16539 1/20 0.33
ALDH1A1 P00352 2/20 0.33
GAPDH P04406 1/20 0.33
APAF1 O14727 1/20 0.33
MITF O75030 1/20 0.33

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
SCHEMBL9713463 0.81 KDM4E (0.48) MAPTKDM4ENSD2MAPK1AURKA
SCHEMBL9713498 0.80 CDC25A (0.47) MAPTKDM4ENSD2MAPK1P4HB
SCHEMBL9713681 0.78 AURKA (0.43) MAPTKDM4ENSD2MAPK1P4HB
SCHEMBL9713612 0.76 KDM4E (0.42) MAPTKDM4ENSD2MAPK1P4HB
SCHEMBL14039802 0.74 MAPT (0.54) MAPTKDM4ENSD2MAPK1P4HB
SCHEMBL9642618 0.73 MAPT (0.53) MAPTKDM4ENSD2MAPK1P4HB
SCHEMBL10355976 0.71 MAPT (0.54) MAPTKDM4ENSD2MAPK1P4HB
SCHEMBL11105060 0.71 KDM4E (0.45) MAPTKDM4ENSD2MAPK1P4HB
SCHEMBL9627478 0.70 AURKA (0.53) MAPTKDM4ENSD2MAPK1AURKA
SCHEMBL30003334 0.70 AURKA (0.53) MAPTKDM4ENSD2MAPK1AURKA

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
US-5091558-A Topical administeration SYNTEX (U.S.A.) INC. (US) 1992-02-25 US disclosed
EP-0150831-B1 NAPHTHALENE ANTI-PSORIATIC AGENTS SYNTEX (U.S.A.) INC. (US) 1988-08-10 EP disclosed
EP-0150831-A2 Naphthalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1985-08-07 EP disclosed