SCHEMBL5405943

SCHEMBL5405943

CCCC(=O)NC1CCCC(Oc2ccc3[nH]ncc3c2C)C1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 9/20 0.39
AXL P30530 1/20 0.37
TYRO3 Q06418 1/20 0.37
MERTK Q12866 1/20 0.37
MTNR1A P48039 1/20 0.37
MTNR1B P49286 1/20 0.37
ROCK2 O75116 1/20 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
SCHEMBL5405935 1.00 TRPV1 (0.39) TRPV1AXLTYRO3MERTKMTNR1A
SCHEMBL5405938 1.00 TRPV1 (0.39) TRPV1AXLTYRO3MERTKMTNR1A
SCHEMBL5412538 0.95 TRPV1 (0.37) TRPV1AXLTYRO3MERTKROCK2
SCHEMBL5412534 0.95 TRPV1 (0.37) TRPV1AXLTYRO3MERTKROCK2
SCHEMBL5412529 0.95 TRPV1 (0.37) TRPV1AXLTYRO3MERTKROCK2
SCHEMBL5414966 0.93 FASN (0.40) TRPV1AXLTYRO3MERTKROCK2
SCHEMBL5414973 0.93 FASN (0.40) TRPV1AXLTYRO3MERTKROCK2
SCHEMBL5414967 0.93 FASN (0.40) TRPV1AXLTYRO3MERTKROCK2
SCHEMBL5412403 0.89 NPSR1 (0.40) TRPV1ROCK2
SCHEMBL5412412 0.89 NPSR1 (0.40) TRPV1ROCK2

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-7199147-B2 Rho kinase inhibitors DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2007-04-03 US disclosed
US-20040138286-A1 Rho kinase inhibitors DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2004-07-15 US disclosed
EP-1403255-A1 Rho KINASE INHIBITORS SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2004-03-31 EP 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-20040138286-A1 Rho kinase inhibitors ROCK1, ROCK2, ARHGDIA TRPV1 4181/4885AXL 1805/4885TYRO3 961/4885

“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.