SCHEMBL16148752

SCHEMBL16148752

CC(C)(C)c1ccc(O)c(C(=O)Nc2ccc(C(=O)O)cc2C(F)(F)F)c1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ NR1H4 Q96RI1 10/20 0.52
▸ PPARG P37231 7/20 0.52
▸ TMPRSS4 Q9NRS4 2/20 0.49
▸ PLG P00747 2/20 0.47
▸ KLK1 P06870 2/20 0.47
▸ KLK6 Q92876 2/20 0.47
▸ KLKB1 P03952 1/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ CYP2D6 P10635 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ SERPINE1 P05121 1/20 0.46
▸ PPARA Q07869 1/20 0.45
▸ PPARD Q03181 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ AKR1C3 P42330 1/20 0.43
▸ EPHX2 P34913 1/20 0.43

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
SCHEMBL16147489 0.89 TMPRSS4 (0.47) TMPRSS4PLGKLK1KLK6KLKB1
SCHEMBL16147354 0.86 NR1H4 (0.60) NR1H4PPARGTMPRSS4PLGKLK1
SCHEMBL16148635 0.84 NR1H4 (0.52) NR1H4PPARGPLGKLK1KLK6
SCHEMBL16147707 0.84 PPARG (0.56) NR1H4PPARGPLGKLK1KLK6
SCHEMBL16149461 0.84 NR1H4 (0.50) NR1H4PPARGPLGKLK1KLK6
SCHEMBL16148214 0.83 NR1H4 (0.51) NR1H4PPARGPLGKLK1KLK6
SCHEMBL16147507 0.83 NR1H4 (0.57) NR1H4PPARGPLGKLK1KLK6
SCHEMBL16147616 0.81 NR1H4 (0.58) NR1H4PPARGRAB9APPARAPPARD
SCHEMBL22153049 0.81 NR1H4 (0.69) NR1H4PPARGPLGKLK1KLK6
SCHEMBL17515737 0.80 RAB9A (0.41) PPARGTMPRSS4CYP1A2CYP2D6CYP2C19

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
WO-2020132700-A1 METHODS OF USING INHIBITORS OF SREBP IN COMBINATION WITH NICLOSAMIDE AND ANALOGS THEREOF Fgh Biotech Inc. (US) 2020-06-25 — — WO disclosed
US-20180370905-A1 Compounds Useful for the Treatment of Metabolic Disorders and Synthesis of the Same NORTH CAROLINA CENTRAL UNIV (US) 2018-12-27 — — US disclosed
US-10005720-B2 Compounds useful for the treatment of metabolic disorders and synthesis of the same NORTH CAROLINA CENTRAL UNIVERSITY (US) 2018-06-26 — — US disclosed
US-10005720-B2 Compounds useful for the treatment of metabolic disorders and synthesis of the same NORTH CAROLINA CENTRAL UNIVERSITY (US) 2018-06-26 — — US disclosed
US-20160046560-A1 COMPOUNDS USEFUL FOR THE TREATMENT OF METABOLIC DISORDERS AND SYNTHESIS OF THE SAME NORTH CAROLINA CENTRAL UNIVERSITY 2016-02-18 — — US disclosed
US-20160046560-A1 COMPOUNDS USEFUL FOR THE TREATMENT OF METABOLIC DISORDERS AND SYNTHESIS OF THE SAME NORTH CAROLINA CENTRAL UNIVERSITY 2016-02-18 — — US disclosed
WO-2014165816-A1 COMPOUNDS USEFUL FOR THE TREATMENT OF METABOLIC DISORDERS AND SYNTHESIS OF THE SAME NORTH CAROLINA CENTRAL UNIVERSITY (US) 2014-10-09 — — WO disclosed
WO-2014165816-A1 COMPOUNDS USEFUL FOR THE TREATMENT OF METABOLIC DISORDERS AND SYNTHESIS OF THE SAME NORTH CAROLINA CENTRAL UNIVERSITY (US) 2014-10-09 — — WO 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-10005720-B2 Compounds useful for the treatment of metabolic disorders and synthesis of the same GLS2, PC, GLS NR1H4 527/4885PPARG 359/4885TMPRSS4 2431/4885
US-20180370905-A1 Compounds Useful for the Treatment of Metabolic Disorders and Synthesis of the Same GLS2, PC, GLS NR1H4 527/4885PPARG 359/4885TMPRSS4 2431/4885
US-20160046560-A1 COMPOUNDS USEFUL FOR THE TREATMENT OF METABOLIC DISORDERS AND SYNTHESIS OF THE SAME GLS2, PC, GLS NR1H4 527/4885PPARG 359/4885TMPRSS4 2431/4885

“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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