SCHEMBL13719403

SCHEMBL13719403

COc1cc(Oc2ccccc2)ccc1CC(C)C

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.48
LTA4H P09960 1/20 0.47
ALDH1A1 P00352 3/20 0.45
KDM4E B2RXH2 2/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
APLNR P35414 1/20 0.42
HTT P42858 2/20 0.42
MAPK1 P28482 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
PPARG P37231 1/20 0.42
PPARD Q03181 1/20 0.42
PPARA Q07869 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
TTR P02766 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
SCHEMBL3027061 0.83 APLNR (0.59) TSHRAPLNR
SCHEMBL16316320 0.82 LTA4H (0.52) LTA4HALDH1A1KDM4EMEN1KMT2A
SCHEMBL22210564 0.81 LTA4H (0.50) LTA4HALDH1A1KDM4EMEN1KMT2A
SCHEMBL21803815 0.80 SLC1A5 (0.47) TSHRLTA4HKDM4EMEN1KMT2A
SCHEMBL13719038 0.79 LTA4H (0.41) TSHRLTA4HALDH1A1PPARGPPARD
SCHEMBL6062347 0.79 LTA4H (0.48) LTA4HALDH1A1PPARGPPARDPPARA
SCHEMBL25809767 0.78 HRH1 (0.58)
SCHEMBL5018921 0.76 SLC6A4 (0.58) PPARA
SCHEMBL7449929 0.76 GABRA1 (0.53) LTA4HALDH1A1PPARGPPARDPPARA
SCHEMBL7445377 0.76 MAOB (0.44) TSHRLTA4HALDH1A1MEN1KMT2A

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 TSHR 780/4885LTA4H 3219/4885ALDH1A1 1055/4885

“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.