SCHEMBL2491587

SCHEMBL2491587

CCCc1ccccc1[C](c1ccccc1CCC)c1ccccc1CCC

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.41
LIPG Q9Y5X9 1/20 0.39
ALDH1A1 P00352 2/20 0.39
LMNA P02545 1/20 0.39
KDR P35968 1/20 0.39
HCRTR1 O43613 3/20 0.38
HCRTR2 O43614 3/20 0.38
HTR1A P08908 1/20 0.38
HTT P42858 1/20 0.38
TP53 P04637 1/20 0.38
DAO P14920 1/20 0.36
GABRA1 P14867 1/20 0.36
GABRB2 P47870 1/20 0.36
KMT2A Q03164 1/20 0.36
TSHR P16473 1/20 0.35

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
SCHEMBL2494562 0.86 LIPG (0.50) LIPGALDH1A1LMNAHTTTP53
SCHEMBL18378183 0.84 ALDH1A1 (0.42) FOLH1LIPGALDH1A1LMNAKDR
SCHEMBL9046425 0.84 ALDH1A1 (0.42) FOLH1LIPGALDH1A1LMNAKDR
SCHEMBL10957114 0.84 ALDH1A1 (0.42) FOLH1LIPGALDH1A1LMNAKDR
SCHEMBL9626488 0.82 FOLH1 (0.47) FOLH1ALDH1A1LMNAKDRHCRTR1
SCHEMBL23965685 0.80 ALDH1A1 (0.40) FOLH1LIPGALDH1A1LMNAKDR
SCHEMBL29590143 0.80 ALDH1A1 (0.40) FOLH1LIPGALDH1A1LMNAKDR
SCHEMBL2125820 0.80 ALDH1A1 (0.47) FOLH1ALDH1A1LMNAKDRHCRTR1
SCHEMBL241263 0.80 FOLH1 (0.66) FOLH1ALDH1A1HTTTSHR
SCHEMBL29424595 0.80 FOLH1 (0.66) FOLH1ALDH1A1HTTTSHR

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 FOLH1 4662/4885LIPG 4511/4885ALDH1A1 1292/4885
US-20150328107-A1 MELANIN PRODUCTION INHIBITOR TYR, MC1R, F12 FOLH1 4467/4885LIPG 4540/4885ALDH1A1 1031/4885
US-20140363389-A1 MELANIN PRODUCTION INHIBITOR TYR, F12, MC1R FOLH1 4510/4885LIPG 4585/4885ALDH1A1 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.