SCHEMBL4798192

SCHEMBL4798192

O=C(c1c(Cl)cccc1Cl)N(C(=O)c1c(Cl)cccc1Cl)c1ccc(CO)cn1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 1/20 0.44
POLB P06746 1/20 0.36
ALDH1A1 P00352 4/20 0.36
MAPT P10636 3/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
KMT2A Q03164 2/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
HSD17B10 Q99714 2/20 0.33
FEN1 P39748 1/20 0.33
MEN1 O00255 1/20 0.33
USP2 O75604 1/20 0.33
HPGD P15428 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ITGB1 P05556 4/20 0.33
ITGA5 P08648 4/20 0.33
ITGB3 P05106 1/20 0.33
ITGAV P06756 1/20 0.33
TP53 P04637 1/20 0.33
XBP1 P17861 1/20 0.33

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
SCHEMBL4802020 0.87 TRPM8 (0.43) TRPM8POLBALDH1A1MAPTSMN1; SMN2
SCHEMBL6742389 0.79 TRPM8 (0.40) TRPM8POLBALDH1A1MAPTSMN1; SMN2
Hydrochloric Acid SCHEMBL6740643 0.76 ITGB1 (0.40) TRPM8ALDH1A1ITGB1ITGA5ITGB3
SCHEMBL7669220 0.75 JAK2 (0.46) POLBALDH1A1MAPTKMT2ARAB9A
SCHEMBL7484451 0.70 MAPT (0.34) TRPM8POLBMAPTSMN1; SMN2RAB9A
SCHEMBL6451838 0.67 SYK (0.36)
SCHEMBL1569639 0.66 HDAC6 (0.40)
SCHEMBL6176392 0.65 AOC3 (0.36) JAK2
SCHEMBL12176776 0.64 TSHR (0.40) KMT2AMEN1
SCHEMBL792607 0.64 JAK2 (0.42) TRPM8ALDH1A1KMT2AMEN1JAK2

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-7361679-B2 2-phenyl-3-heteroarylpropionic acid derivative or salt thereof and medicine containing the same KAKEN PHARMACEUTICAL CO., LTD. (JP) 2008-04-22 US disclosed
US-7361679-B2 2-phenyl-3-heteroarylpropionic acid derivative or salt thereof and medicine containing the same KAKEN PHARMACEUTICAL CO., LTD. (JP) 2008-04-22 US disclosed
US-7361679-B2 2-phenyl-3-heteroarylpropionic acid derivative or salt thereof and medicine containing the same KAKEN PHARMACEUTICAL CO., LTD. (JP) 2008-04-22 US disclosed
US-20040259908-A1 2-phenyl-3-heteroarylpropionic acid derivative or salt thereof and medicine containing the same KAKEN PHARMACEUTICAL CO., LTD. (JP) 2004-12-23 US disclosed
EP-1084119-B1 AROMATIC AMINE DERIVATIVES AS PHARMACEUTICAL AGENTS CELLTECH THERAPEUTICS LTD (GB) 2004-09-08 EP disclosed
EP-1426360-A1 2-PHENYL-3-HETEROARYLPROPIONIC ACID DERIVATIVE OR SALT THEREOF AND MEDICINE CONTAINING THE SAME Kaken Pharmaceutical Co., Ltd. (JP) 2004-06-09 EP disclosed
US-6369229-B1 IMMUNOLOGY AND ANTIINFLAMMATORY AGENTS CELLTECH THERAPEUTICS, LIMITED (GB) 2002-04-09 US disclosed
US-6110945-A AN ANTIINFLAMMATORY AGENT INHIBITING THE BINDING OF INTEGRINS TO THEIR LIGANDS; IN THE PROPHYLAXIS FOR TREATING IMMUNE OR INFLAMMATORY DISORDERS CELLTECH THERAPEUTICS LIMITED (GB) 2000-08-29 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-20040259908-A1 2-phenyl-3-heteroarylpropionic acid derivative or salt thereof and medicine containing the same LPAR4, LPAR2, LPAR1 TRPM8 1038/4885POLB 4373/4885ALDH1A1 486/4885

“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.