SCHEMBL7791677

SCHEMBL7791677

CC=Cc1cc2c(cc1Oc1cccc(F)c1C(=O)OCC)OCO2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.39
MAPT P10636 7/20 0.39
NPC1 O15118 6/20 0.39
ALDH1A1 P00352 5/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
KDM4E B2RXH2 3/20 0.39
LMNA P02545 3/20 0.39
MAPK1 P28482 2/20 0.39
POLB P06746 2/20 0.39
PRKCI P41743 1/20 0.38
PRKCZ Q05513 1/20 0.38
CYP1A2 P05177 2/20 0.37
CYP3A4 P08684 2/20 0.37
CYP2C9 P11712 2/20 0.37
CYP2C19 P33261 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
TP53 P04637 3/20 0.37
TSHR P16473 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
MEN1 O00255 2/20 0.36

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
SCHEMBL7791675 1.00 RAB9A (0.39) RAB9AMAPTNPC1ALDH1A1SMN1; SMN2
SCHEMBL7791661 0.86 MAPT (0.45) RAB9AMAPTNPC1ALDH1A1SMN1; SMN2
SCHEMBL7799731 0.82 MGAM (0.40) RAB9AMAPTNPC1ALDH1A1SMN1; SMN2
SCHEMBL7790974 0.80 MAPT (0.50) RAB9AMAPTNPC1ALDH1A1SMN1; SMN2
SCHEMBL7791773 0.80 PRKCZ (0.42) RAB9AMAPTNPC1ALDH1A1SMN1; SMN2
SCHEMBL7791771 0.80 PRKCZ (0.42) RAB9AMAPTNPC1ALDH1A1SMN1; SMN2
SCHEMBL7791680 0.78 MAPT (0.42) RAB9AMAPTNPC1ALDH1A1SMN1; SMN2
SCHEMBL7791682 0.78 MAPT (0.42) RAB9AMAPTNPC1ALDH1A1SMN1; SMN2
SCHEMBL7799670 0.76 MAPT (0.48) RAB9AMAPTNPC1ALDH1A1SMN1; SMN2
SCHEMBL7797642 0.74 MAOB (0.39) RAB9AMAPTNPC1ALDH1A1SMN1; SMN2

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-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

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 RAB9A 3305/4885MAPT 4496/4885NPC1 2650/4885

“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.