SCHEMBL2489196

SCHEMBL2489196

[CH2]c1cccc(-c2ccccc2NCCCC)c1-c1ccccc1NCCCC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.40
KMT2A Q03164 6/20 0.40
ALDH1A1 P00352 3/20 0.40
POLB P06746 3/20 0.40
CASP1 P29466 2/20 0.40
APAF1 O14727 1/20 0.40
L3MBTL1 Q9Y468 5/20 0.39
HTT P42858 4/20 0.39
NPSR1 Q6W5P4 4/20 0.39
MAPT P10636 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
MAPK1 P28482 3/20 0.39
USP2 O75604 3/20 0.39
ATM Q13315 2/20 0.39
TLR9 Q9NR96 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
HPGD P15428 1/20 0.39
RGS12 O14924 1/20 0.39
TLR8 Q9NR97 1/20 0.38
BCHE P06276 1/20 0.37

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
SCHEMBL2488749 0.91 IDO1 (0.41) MEN1KMT2AALDH1A1POLBCASP1
SCHEMBL2494990 0.87 ALDH1A1 (0.44) MEN1KMT2AALDH1A1POLBCASP1
SCHEMBL2492175 0.84 MEN1 (0.47) MEN1KMT2AALDH1A1POLBCASP1
SCHEMBL5122678 0.80 TLR8 (0.46) ALDH1A1POLBAPAF1L3MBTL1HTT
SCHEMBL1926387 0.78 L3MBTL1 (0.48) ALDH1A1APAF1L3MBTL1HTTNPSR1
SCHEMBL2492356 0.77 IDO1 (0.46) MEN1KMT2AALDH1A1POLBCASP1
SCHEMBL2493433 0.75 MAPT (0.46) MEN1KMT2AALDH1A1POLBCASP1
SCHEMBL7696988 0.75 L3MBTL1 (0.46) ALDH1A1L3MBTL1HTTNPSR1MAPT
SCHEMBL1580117 0.74 MEN1 (0.45) MEN1KMT2AALDH1A1POLBCASP1
SCHEMBL309485 0.74 TLR8 (0.53) ALDH1A1POLBAPAF1L3MBTL1HTT

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 MEN1 1585/4885KMT2A 2108/4885ALDH1A1 1292/4885
US-20150328107-A1 MELANIN PRODUCTION INHIBITOR TYR, MC1R, F12 MEN1 1346/4885KMT2A 2219/4885ALDH1A1 1031/4885
US-20140363389-A1 MELANIN PRODUCTION INHIBITOR TYR, F12, MC1R MEN1 1200/4885KMT2A 2287/4885ALDH1A1 1187/4885

“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.