SCHEMBL2491446

SCHEMBL2491446

COc1c(COCCCO)ccc(-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 6/20 0.40
PDE4A P27815 5/20 0.40
PDE4C Q08493 5/20 0.40
PDE4D Q08499 5/20 0.40
SI P14410 6/20 0.36
MGAM O43451 5/20 0.36
GAA P10253 4/20 0.36
MGAM2 Q2M2H8 4/20 0.36
GBA1 P04062 2/20 0.34
LCT P09848 2/20 0.34
UGCG Q16739 2/20 0.34
GBA2 Q9HCG7 2/20 0.34
S1PR3 Q99500 2/20 0.34
PDCD1 Q15116 1/20 0.34
CD274 Q9NZQ7 1/20 0.34
ALOX5AP P20292 1/20 0.33
FEN1 P39748 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
BACE1 P56817 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
SCHEMBL2494551 0.92 PDE4B (0.42) PDE4BPDE4APDE4CPDE4DSI
SCHEMBL2491451 0.88 PDE4B (0.37) PDE4BPDE4APDE4CPDE4DSI
SCHEMBL2489421 0.85 PDE4B (0.38) PDE4BPDE4APDE4CPDE4DSI
SCHEMBL2489198 0.83 S1PR3 (0.37) SIMGAMGBA1LCTUGCG
SCHEMBL2492115 0.82 GBA1 (0.36) PDE4BPDE4APDE4CPDE4DSI
SCHEMBL2492411 0.81 GBA1 (0.36) SIMGAMGBA1LCTUGCG
SCHEMBL2492867 0.77 CD274 (0.53) PDCD1CD274L3MBTL1
SCHEMBL2491619 0.74 CD274 (0.39) S1PR3PDCD1CD274
SCHEMBL2490781 0.74 CD274 (0.52) PDCD1CD274L3MBTL1
SCHEMBL2491936 0.73 ALDH1A1 (0.38) PDE4BPDE4APDE4CPDE4DBACE1

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 PDE4B 3369/4885PDE4A 3692/4885PDE4C 3970/4885
US-20150328107-A1 MELANIN PRODUCTION INHIBITOR TYR, MC1R, F12 PDE4B 3383/4885PDE4A 3742/4885PDE4C 4030/4885
US-20140363389-A1 MELANIN PRODUCTION INHIBITOR TYR, F12, MC1R PDE4B 3329/4885PDE4A 3692/4885PDE4C 4023/4885

“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.