SCHEMBL3817985

SCHEMBL3817985

CC(C)Cc1ccc(C(C)C(=O)NCCCN(C)C)cc1

nearest known ligand 0.63

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.63
BCHE P06276 1/20 0.63
ACHE P22303 1/20 0.63
TRPV1 Q8NER1 7/20 0.60
CHRM1 P11229 1/20 0.58
PDE4A P27815 1/20 0.58
CA12 O43570 3/20 0.56
CA1 P00915 3/20 0.56
CA2 P00918 3/20 0.56
CA4 P22748 3/20 0.56
CA9 Q16790 3/20 0.56
CXCR1 P25024 1/20 0.55
CXCR2 P25025 1/20 0.55

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
SCHEMBL4431747 1.00 APP (0.63) APPBCHEACHETRPV1CHRM1
Hydrochloric Acid SCHEMBL4421826 0.99 APP (0.62) APPBCHEACHETRPV1CHRM1
Hydrochloric Acid SCHEMBL4743234 0.99 APP (0.62) APPBCHEACHETRPV1CHRM1
Hydrochloric Acid SCHEMBL4743230 0.99 APP (0.62) APPBCHEACHETRPV1CHRM1
SCHEMBL7167066 0.96 APP (0.62) APPBCHEACHETRPV1CHRM1
SCHEMBL4908720 0.96 APP (0.62) APPBCHEACHETRPV1CHRM1
Hydrochloric Acid SCHEMBL4909193 0.95 APP (0.61) APPBCHEACHETRPV1CHRM1
Hydrochloric Acid SCHEMBL4419816 0.95 APP (0.61) APPBCHEACHETRPV1CHRM1
SCHEMBL4431787 0.92 CHRM1 (0.61) APPBCHEACHETRPV1CHRM1
SCHEMBL3820586 0.92 CHRM1 (0.61) APPBCHEACHETRPV1CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3210964-A1 POSITIVELY CHARGED WATER-SOLUBLE PRODRUGS OF IBUPROFEN WITH VERY FAST SKIN PENETRATION RATE Techfields Biochem Co. Ltd (CN) 2017-08-30 EP claimed
EP-1366018-B1 OMEGA-AMINOALKYLAMIDES OF (R)-2-ARYL-PROPIONIC ACIDS AS INHIBITORS OF THE CHEMOTAXIS OF POLYMORPHONUCLEATE AND MONONUCLEATE CELLS DOMPÉ FARMACEUTICI S P A (IT) 2016-07-06 EP claimed
CN-1538951-B Omega-aminoalkylamides of R-2-aryl-propionic acids as inhibitors of chemotaxis of polymorphonucleate and mononucleate cells DOMPE SPA 2013-08-28 CN claimed
US-20090238763-A1 HIGH PENETRATION COMPOSITIONS AND USES THEREOF TECHFIELDS PHARMA CO., LTD. (CN) 2009-09-24 US claimed
CN-1538951-A Omega-aminoalkylamides of R-2-aryl-propionic acids as inhibitors of chemotaxis of polymorphonucleate and mononucleate cells ��ķ�ɷ����޹�˾ 2004-10-20 CN claimed
CN-1538951-B Omega-aminoalkylamides of R-2-aryl-propionic acids as inhibitors of chemotaxis of polymorphonucleate and mononucleate cells DOMPE SPA 2013-08-28 CN disclosed
CN-1538951-A Omega-aminoalkylamides of R-2-aryl-propionic acids as inhibitors of chemotaxis of polymorphonucleate and mononucleate cells ��ķ�ɷ����޹�˾ 2004-10-20 CN 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-20090238763-A1 HIGH PENETRATION COMPOSITIONS AND USES THEREOF HPGDS, PTGIS, PTGES APP 1270/4885BCHE 1180/4885ACHE 2313/4885

“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.