SCHEMBL2493484

SCHEMBL2493484

Cc1c(COCCN)ccc(-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 7/20 0.40
TP53 P04637 1/20 0.40
MAPK1 P28482 1/20 0.40
RAB9A P51151 1/20 0.40
DPP4 P27487 1/20 0.35
PDCD1 Q15116 2/20 0.35
PTGS1 P23219 1/20 0.33
ESR2 Q92731 1/20 0.33
TAAR1 Q96RJ0 1/20 0.33
SQOR Q9Y6N5 1/20 0.32
S1PR3 Q99500 1/20 0.31
TACR1 P25103 1/20 0.31
AR P10275 1/20 0.31

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
SCHEMBL2493521 0.92 CD274 (0.35) CD274TP53MAPK1RAB9ADPP4
SCHEMBL2491619 0.87 CD274 (0.39) CD274PDCD1PTGS1ESR2S1PR3
SCHEMBL2489198 0.84 S1PR3 (0.37) CD274PDCD1PTGS1ESR2S1PR3
SCHEMBL2489421 0.83 PDE4B (0.38) CD274TP53MAPK1RAB9ADPP4
SCHEMBL2492905 0.82 TP53 (0.40) CD274TP53MAPK1RAB9ADPP4
SCHEMBL2491451 0.75 PDE4B (0.37) CD274TP53MAPK1RAB9ADPP4
SCHEMBL2489577 0.74 GBA1 (0.35) TP53MAPK1RAB9ADPP4PTGS1
SCHEMBL2490820 0.73 TAAR1 (0.39) CD274TP53MAPK1RAB9ATAAR1
SCHEMBL9840549 0.71 ELANE (0.41) CD274RAB9APDCD1PTGS1
SCHEMBL2491936 0.70 ALDH1A1 (0.38) ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 CD274 3091/4885TP53 4826/4885MAPK1 172/4885
US-20150328107-A1 MELANIN PRODUCTION INHIBITOR TYR, MC1R, F12 CD274 2885/4885TP53 4797/4885MAPK1 221/4885
US-20140363389-A1 MELANIN PRODUCTION INHIBITOR TYR, F12, MC1R CD274 2825/4885TP53 4787/4885MAPK1 194/4885

“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.