SCHEMBL13719216

SCHEMBL13719216

CC(C)Cc1cccc(Oc2ccc(Cl)c(Cl)c2)c1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KMO O15229 1/20 0.48
▸ PNMT P11086 1/20 0.47
▸ FDFT1 P37268 3/20 0.47
▸ TAAR1 Q96RJ0 2/20 0.45
▸ PPARG P37231 2/20 0.45
▸ PPARA Q07869 2/20 0.45
▸ HSP90AA1 P07900 1/20 0.44
▸ HTR2A P28223 4/20 0.43
▸ SLC6A4 P31645 4/20 0.43
▸ KCNH2 Q12809 4/20 0.43
▸ CETP P11597 2/20 0.42
▸ FAAH O00519 1/20 0.42
▸ SLC6A2 P23975 1/20 0.41
▸ SLC6A3 Q01959 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41

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
SCHEMBL9538055 0.87 TAAR1 (0.56) PNMTFDFT1TAAR1PPARGPPARA
SCHEMBL13719088 0.86 PPARG (0.59) PNMTFDFT1TAAR1PPARGPPARA
SCHEMBL13719005 0.83 TAAR1 (0.46) PNMTFDFT1TAAR1PPARGPPARA
SCHEMBL16316249 0.82 KMO (0.51) KMOFDFT1HSP90AA1HTR2ASLC6A4
SCHEMBL8174800 0.82 CETP (0.54) FDFT1TAAR1PPARGPPARACETP
SCHEMBL13718930 0.81 TAAR1 (0.60) TAAR1PPARGPPARASLC6A4CETP
SCHEMBL13718948 0.81 FFAR1 (0.48) FDFT1TAAR1PPARGPPARACETP
SCHEMBL19002457 0.81 KMO (0.48) KMOPNMTFDFT1PPARGPPARA
SCHEMBL8171976 0.79 CETP (0.47) FDFT1TAAR1PPARGPPARACETP
SCHEMBL4160110 0.79 KMO (0.51) KMOFDFT1PPARGPPARAHSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7579479-B2 Substituted acid derivatives useful as antidiabetic and antiobesity agents and method BRISTOL-MYERS SQUIBB COMPANY (US) 2009-08-25 — — US disclosed
US-7241780-B2 Substituted acid derivatives useful as antidiabetic and antiobesity agents and method BRISTOLS-MYERS SQUIBB COMPANY (US) 2007-07-10 — — US disclosed
US-20070015797-A1 Substituted acid derivatives useful as antidiabetic and antiobesity agents and method CHENG PETER T 2007-01-18 — — 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-20070015797-A1 Substituted acid derivatives useful as antidiabetic and antiobesity agents and method GPR119, LIPC, ACACA KMO 2649/4885PNMT 2176/4885FDFT1 1139/4885

“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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