SCHEMBL5099780

SCHEMBL5099780

Cc1cc(NC(=O)Cc2cc(C(=N)N)ccc2O)ccc1C(=O)N1CCCC1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 6/20 0.42
PRSS1 P07477 3/20 0.42
GAA P10253 2/20 0.41
ALDH1A1 P00352 1/20 0.41
HSD11B1 P28845 2/20 0.41
NAMPT P43490 2/20 0.39
HTT P42858 1/20 0.39
F2 P00734 3/20 0.39
PLAU P00749 3/20 0.39
PLG P00747 2/20 0.39
ST14 Q9Y5Y6 1/20 0.39
HPGD P15428 2/20 0.38
MEN1 O00255 1/20 0.38
MAPK1 P28482 1/20 0.38
KMT2A Q03164 1/20 0.38
PLAT P00750 2/20 0.37
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA7 P43166 1/20 0.37

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
Hydrochloric Acid SCHEMBL5091399 0.99 F10 (0.42) F10PRSS1GAAALDH1A1HSD11B1
SCHEMBL7525319 0.90 F10 (0.42) F10PRSS1HSD11B1F2PLAU
Hydrochloric Acid SCHEMBL7124790 0.90 F10 (0.41) F10PRSS1HSD11B1F2PLAU
SCHEMBL2997836 0.86 F10 (0.55) F10PRSS1ALDH1A1HSD11B1HTT
Hydrochloric Acid SCHEMBL5089043 0.85 F10 (0.54) F10PRSS1ALDH1A1HSD11B1HTT
SCHEMBL5094210 0.85 F10 (0.54) F10PRSS1ALDH1A1HSD11B1HTT
Hydrochloric Acid SCHEMBL5099667 0.84 F10 (0.53) F10PRSS1ALDH1A1HSD11B1HTT
SCHEMBL7123529 0.80 F10 (0.39) F10PRSS1HSD11B1F2
Hydrochloric Acid SCHEMBL7114852 0.80 F10 (0.39) F10PRSS1HSD11B1F2
Hydrochloric Acid SCHEMBL5089123 0.78 F10 (0.45) F10PRSS1ALDH1A1F2PLAU

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7425641-B2 Carboxylic acid amides, the preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA KG (DE) 2008-09-16 US claimed
US-20050065346-A1 Carboxylic acid amides, the preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA KG (DE) 2005-03-24 US claimed

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-20050065346-A1 Carboxylic acid amides, the preparation thereof and their use as pharmaceutical compositions F12, F11, F2 F10 23/4885PRSS1 957/4885GAA 502/4885

“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.