SCHEMBL2493434

SCHEMBL2493434

COc1ccccc1-c1cccc(CN2CCCC2)c1-c1ccccc1OC

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 7/20 0.58
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
HRH3 Q9Y5N1 1/20 0.56
DRD2 P14416 2/20 0.53
DRD4 P21917 2/20 0.53
HRH2 P25021 2/20 0.53
HRH1 P35367 2/20 0.53
DRD3 P35462 2/20 0.53
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
TSHR P16473 1/20 0.48
SIGMAR1 Q99720 1/20 0.48
KCNH2 Q12809 2/20 0.47
SCN9A Q15858 1/20 0.47

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
SCHEMBL2492921 0.99 MEN1 (0.59) HTR7MEN1KMT2AHRH3DRD2
SCHEMBL6793302 0.88 HTR7 (0.72) HTR7MEN1KMT2AHRH3DRD2
SCHEMBL2490806 0.88 HTR7 (0.54) HTR7DRD2DRD4HRH2HRH1
SCHEMBL13284339 0.81 MEN1 (0.79) MEN1KMT2AHRH3DRD2KDM4E
SCHEMBL3161038 0.80 MEN1 (0.82) MEN1KMT2AHRH3DRD2DRD4
SCHEMBL2491500 0.78 KMT2A (0.49) HTR7MEN1KMT2AHRH3KDM4E
SCHEMBL26125669 0.78 MEN1 (0.49) HTR7MEN1KMT2ADRD2DRD4
SCHEMBL22810443 0.77 KMT2A (0.71) MEN1KMT2AHRH3DRD2DRD4
SCHEMBL9831188 0.77 KDM4E (0.69) MEN1KMT2AHRH3KDM4EALDH1A1
SCHEMBL12856249 0.77 MEN1 (0.72) MEN1KMT2AHRH3DRD2KDM4E

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
EP-2380567-B1 MELANIN PRODUCTION INHIBITOR POLA CHEM IND INC (JP) 2019-01-16 EP disclosed
EP-3009123-A1 MELANIN PRODUCTION INHIBITOR Pola Chemical Industries Inc. (JP) 2016-04-20 EP disclosed
US-20150328107-A1 MELANIN PRODUCTION INHIBITOR POLA CHEMICAL INDUSTRIES INC. (JP) 2015-11-19 US disclosed
EP-2845587-A2 Melanin production inhibitor Pola Chemical Industries Inc. (JP) 2015-03-11 EP disclosed
US-20140363389-A1 MELANIN PRODUCTION INHIBITOR POLA CHEMICAL INDUSTRIES INC. (JP) 2014-12-11 US disclosed
US-8846012-B2 Melanin production inhibitor POLA CHEMICAL INDUSTRIES INC. (JP) 2014-09-30 US disclosed
EP-2380567-A1 MELANIN PRODUCTION INHIBITOR Pola Chemical Industries Inc. (JP) 2011-10-26 EP disclosed
US-20110243865-A1 MELANIN PRODUCTION INHIBITOR POLA CHEMICAL INDUSTRIES INC. (JP) 2011-10-06 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110243865-A1 MELANIN PRODUCTION INHIBITOR TYR, F12, TH HTR7 241/4885MEN1 1585/4885KMT2A 2108/4885
US-20150328107-A1 MELANIN PRODUCTION INHIBITOR TYR, MC1R, F12 HTR7 164/4885MEN1 1346/4885KMT2A 2219/4885
US-20140363389-A1 MELANIN PRODUCTION INHIBITOR TYR, F12, MC1R HTR7 178/4885MEN1 1200/4885KMT2A 2287/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.