SCHEMBL14878570

SCHEMBL14878570

COC(=O)c1cc(CNc2cc(Oc3ccccc3)ccc2C)ccc1OC

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HDAC8 Q9BY41 3/20 0.53
▸ LMNA P02545 4/20 0.49
▸ HPGD P15428 2/20 0.49
▸ PPARG P37231 2/20 0.48
▸ PPARA Q07869 2/20 0.48
▸ PPARD Q03181 1/20 0.48
▸ GAA P10253 3/20 0.44
▸ KDM4C Q9H3R0 1/20 0.43
▸ ALDH1A1 P00352 3/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ HTT P42858 1/20 0.43
▸ FFAR1 O14842 2/20 0.42
▸ MAPT P10636 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ HDAC1 Q13547 1/20 0.42
▸ HDAC6 Q9UBN7 1/20 0.42

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
SCHEMBL12139195 0.88 HDAC8 (0.52) HDAC8LMNAHPGDPPARGPPARA
SCHEMBL8009994 0.88 HDAC8 (0.54) HDAC8LMNAHPGDPPARGPPARA
SCHEMBL12139167 0.85 AKR1B10 (0.51) HDAC8LMNAHPGDPPARGPPARA
SCHEMBL14878552 0.81 HIF1A (0.54) HDAC8ALDH1A1KDM4ESMN1; SMN2HTT
SCHEMBL8012083 0.78 HDAC8 (0.50) HDAC8PPARGPPARAPPARDGAA
SCHEMBL13133475 0.75 HPGD (0.55) LMNAHPGDPPARGPPARAPPARD
SCHEMBL15028056 0.73 NR1H4 (0.53) LMNAHPGDGAAALDH1A1KDM4E
SCHEMBL8570550 0.73 MEN1 (0.53) LMNAHPGDPPARGPPARAPPARD
SCHEMBL4446937 0.72 HPGD (0.52) LMNAHPGDGAAALDH1A1KDM4E
SCHEMBL6141248 0.71 FFAR1 (0.56) HDAC8GAAALDH1A1KDM4EFFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140315886-A1 QUINAZOLINES AS THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2014-10-23 — — US disclosed
US-8426607-B2 Substituted amino-benzimidazoles, medicaments comprimising said compound, their use and their method of manufacture BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-04-23 — — 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 (1 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-20140315886-A1 QUINAZOLINES AS THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE PPP2CA, PPP4C, PPP3CB HDAC8 1077/4885LMNA 4832/4885HPGD 4227/4885

“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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