SCHEMBL7791692

SCHEMBL7791692

Cc1ccc(Oc2cccc(Oc3ccc(C)cc3)c2C(=O)O)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.55
CA1 P00915 1/20 0.55
CA2 P00918 1/20 0.55
CA7 P43166 1/20 0.55
CA9 Q16790 1/20 0.55
CA14 Q9ULX7 1/20 0.55
LMNA P02545 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.44
CASP1 P29466 1/20 0.44
HTR2A P28223 2/20 0.44
SLC6A4 P31645 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
MMP13 P45452 1/20 0.43
HTT P42858 1/20 0.43
ALDH1A1 P00352 3/20 0.43
POLB P06746 2/20 0.43
FFAR4 Q5NUL3 1/20 0.43
GAA P10253 1/20 0.43
CRHBP P24387 1/20 0.43
FNTA P49354 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
SCHEMBL8542954 1.00 CA12 (0.55) CA12CA1CA2CA7CA9
SCHEMBL7800990 0.85 CA1 (0.66) CA12CA1CA2CA7CA9
SCHEMBL7799672 0.84 CA12 (0.57) CA12CA1CA2CA7CA9
SCHEMBL8542958 0.84 LMNA (0.45) LMNAL3MBTL1CASP1HTR2ASLC6A4
SCHEMBL11473870 0.82 CA12 (0.55) CA12CA1CA2CA7CA9
SCHEMBL7799665 0.82 NPC1 (0.47) LMNASMN1; SMN2ALDH1A1KDM4E
SCHEMBL8547479 0.82 NPC1 (0.47) LMNASMN1; SMN2ALDH1A1KDM4E
SCHEMBL1655946 0.80 CA12 (0.48) CA12CA1CA2CA7CA9
SCHEMBL30775034 0.80 HTT (0.59) LMNAHTTALDH1A1POLBGAA
SCHEMBL366 0.80 HTT (0.59) LMNAHTTALDH1A1POLBGAA

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
US-5977117-A Substituted phenyl compounds and derivatives thereof that modulate the activity of endothelin TEXAS BIOTECHNOLOGY CORPORATION (US) 1999-11-02 US claimed
EP-0876364-A2 SUBSTITUTED PHENYL COMPOUNDS AND DERIVATIVES THEREOF THAT MODULATE THE ACTIVITY OF ENDOTHELIN TEXAS BIOTECHNOLOGY CORPORATION (US) 1998-11-11 EP claimed
WO-1997025321-A2 SUBSTITUTED PHENYL COMPOUNDS AND DERIVATIVES THEREOF THAT MODULATE THE ACTIVITY OF ENDOTHELIN TEXAS BIOTECHNOLOGY CORPORATION (US) 1997-07-17 WO claimed
US-20010014694-A1 Substituted phenyl compounds and derivatives thereof that modulate the activity of endothelin ENCYSIVE PHARMACEUTICALS, INC. 2001-08-16 US disclosed
US-6265428-B1 VASODILATION TEXAS BIOTECHNOLOGY CORPORATION 2001-07-24 US disclosed
US-5977117-A Substituted phenyl compounds and derivatives thereof that modulate the activity of endothelin TEXAS BIOTECHNOLOGY CORPORATION (US) 1999-11-02 US disclosed
EP-0876364-A2 SUBSTITUTED PHENYL COMPOUNDS AND DERIVATIVES THEREOF THAT MODULATE THE ACTIVITY OF ENDOTHELIN TEXAS BIOTECHNOLOGY CORPORATION (US) 1998-11-11 EP disclosed
WO-1997025321-A2 SUBSTITUTED PHENYL COMPOUNDS AND DERIVATIVES THEREOF THAT MODULATE THE ACTIVITY OF ENDOTHELIN TEXAS BIOTECHNOLOGY CORPORATION (US) 1997-07-17 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 (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-20010014694-A1 Substituted phenyl compounds and derivatives thereof that modulate the activity of endothelin EDNRA, EDNRB, NPR1 CA12 4549/4885CA1 3038/4885CA2 1086/4885

“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.