SCHEMBL2491952

SCHEMBL2491952

OCc1ccc(-c2cccc3ccccc23)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC8 Q9BY41 1/20 0.53
▸ HDAC6 Q9UBN7 1/20 0.53
▸ CA12 O43570 3/20 0.50
▸ CA1 P00915 3/20 0.50
▸ CA2 P00918 3/20 0.50
▸ CA9 Q16790 3/20 0.50
▸ PPARG P37231 8/20 0.49
▸ PPARA Q07869 8/20 0.49
▸ CYP2C9 P11712 2/20 0.46
▸ CYP2C19 P33261 2/20 0.46
▸ PPARD Q03181 1/20 0.46
▸ MCL1 Q07820 1/20 0.46
▸ ACMSD Q8TDX5 1/20 0.46
▸ ENPP3 O14638 1/20 0.46
▸ ENPP1 P22413 1/20 0.46
▸ CYP1A2 P05177 1/20 0.45
▸ TSHR P16473 1/20 0.44
▸ CHRNB4 P30926 1/20 0.44
▸ CHRNA3 P32297 1/20 0.44
▸ CHRNA7 P36544 1/20 0.44

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
SCHEMBL3798335 0.85 CA12 (0.62) HDAC8HDAC6CA12CA1CA2
SCHEMBL8407775 0.85 HDAC8 (0.46) HDAC8HDAC6CA12CA1CA2
SCHEMBL20434263 0.85 HDAC8 (0.50) HDAC8HDAC6CA12CA1CA2
SCHEMBL27629006 0.84 CA12 (0.54) HDAC8HDAC6CA12CA1CA2
SCHEMBL30122908 0.83 CA12 (0.66) HDAC8HDAC6CA12CA1CA2
SCHEMBL10600163 0.82 CHRNB4 (0.50) HDAC8HDAC6CA12CA1CA2
SCHEMBL28181881 0.82 CA12 (0.49) HDAC8HDAC6CA12CA1CA2
SCHEMBL6870211 0.81 CA12 (0.47) HDAC8HDAC6CA12CA1CA2
SCHEMBL8363337 0.80 RXRA (0.60) HDAC8HDAC6PPARGPPARACYP2C9
SCHEMBL316112 0.80 TNF (0.57) HDAC8HDAC6CA12CA1CA2

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-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
US-20060252645-A1 Method for producing material containing sensitizer dispersed therein for thermal recording article an thermal recording article SANKO CO., LTD. (JP) 2006-11-09 — — 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 HDAC8 1044/4885HDAC6 1020/4885CA12 2755/4885
US-20150328107-A1 MELANIN PRODUCTION INHIBITOR TYR, MC1R, F12 HDAC8 1374/4885HDAC6 1317/4885CA12 2521/4885
US-20140363389-A1 MELANIN PRODUCTION INHIBITOR TYR, F12, MC1R HDAC8 1281/4885HDAC6 1273/4885CA12 2538/4885

“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.

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