SCHEMBL3816420

SCHEMBL3816420

NCCn1cnc2cc(C(=O)O)ccc21

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HCAR3 P49019 3/20 0.54
FGFR1 P11362 1/20 0.54
THRB P10828 1/20 0.51
HPGD P15428 3/20 0.50
HSD17B10 Q99714 2/20 0.50
GAA P10253 1/20 0.50
ALDH1A1 P00352 1/20 0.50
LMNA P02545 1/20 0.50
EGLN3 Q9H6Z9 1/20 0.49
F10 P00742 1/20 0.48
MAPT P10636 1/20 0.48
PLA2G4A P47712 1/20 0.46
TBXA2R P21731 1/20 0.45

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
SCHEMBL31183038 0.87 HCAR3 (0.55) HCAR3FGFR1THRBHPGDHSD17B10
SCHEMBL30138443 0.85 HCAR3 (0.58) HCAR3FGFR1HPGDHSD17B10ALDH1A1
SCHEMBL3436680 0.85 HCAR3 (0.58) HCAR3FGFR1HPGDHSD17B10ALDH1A1
SCHEMBL14530793 0.83 HCAR3 (0.52) HCAR3FGFR1THRBHPGDHSD17B10
SCHEMBL30930540 0.83 HPGD (0.68) HCAR3FGFR1HPGDHSD17B10GAA
SCHEMBL15174662 0.83 HSD17B10 (0.44) HCAR3FGFR1THRBHPGDHSD17B10
SCHEMBL2996553 0.82 HCAR3 (0.60) HCAR3FGFR1THRBHPGDHSD17B10
SCHEMBL31159882 0.82 HCAR3 (0.56) HCAR3FGFR1THRBHPGDHSD17B10
SCHEMBL1065952 0.82 HCAR3 (0.56) HCAR3FGFR1THRBHPGDHSD17B10
SCHEMBL1307081 0.82 HCAR3 (0.50) HCAR3FGFR1THRBHPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110312949-A1 PHARMACEUTICAL USE OF SUBSTITUTED AMIDES HIGH POINT PHARMACEUTICALS, LLC (US) 2011-12-22 US disclosed
US-20090118259-A1 PHARMACEUTICAL USE OF SUBSTITUTED AMIDES HIGH POINT PHARMACEUTICALS, LLC 2009-05-07 US disclosed
CN-101355938-A Pharmaceutical use of substituted amides TRANSTECH PHARMA INC (US) 2009-01-28 CN disclosed
EP-1945207-A2 PHARMACEUTICAL USE OF SUBSTITUTED AMIDES Transtech Pharma, Inc. (US) 2008-07-23 EP disclosed
WO-2007051811-A2 PHARMACEUTICAL USE OF SUBSTITUTED AMIDES TRANSTECH PHARMA (US) 2007-05-10 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 (2 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-20090118259-A1 PHARMACEUTICAL USE OF SUBSTITUTED AMIDES HSD11B1, CYP11B1, HSD11B2 HCAR3 506/4885FGFR1 3010/4885THRB 1657/4885
US-20110312949-A1 PHARMACEUTICAL USE OF SUBSTITUTED AMIDES HSD11B1, HSD3B1, HSD11B2 HCAR3 488/4885FGFR1 3384/4885THRB 1182/4885

“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.