SCHEMBL18733370

SCHEMBL18733370

CCCCCCCCNC(=O)CCCCC

nearest known ligand 0.83

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CASP2 P42575 1/20 0.83
▸ FAAH O00519 4/20 0.78
▸ NAAA Q02083 1/20 0.77
▸ DNM1 Q05193 2/20 0.72
▸ EPHX2 P34913 3/20 0.69
▸ SLC6A5 Q9Y345 2/20 0.67
▸ EPHX1 P07099 4/20 0.64
▸ HSP90AA1 P07900 1/20 0.61

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
SCHEMBL819566 1.00 CASP2 (0.83) CASP2FAAHNAAADNM1EPHX2
SCHEMBL10790501 1.00 CASP2 (0.83) CASP2FAAHNAAADNM1EPHX2
SCHEMBL22271678 1.00 CASP2 (0.83) CASP2FAAHNAAADNM1EPHX2
SCHEMBL2150966 1.00 CASP2 (0.83) CASP2FAAHNAAADNM1EPHX2
SCHEMBL8368632 1.00 CASP2 (0.83) CASP2FAAHNAAADNM1EPHX2
SCHEMBL498043 1.00 CASP2 (0.83) CASP2FAAHNAAADNM1EPHX2
SCHEMBL23775006 1.00 CASP2 (0.83) CASP2FAAHNAAADNM1EPHX2
SCHEMBL21234011 1.00 CASP2 (0.83) CASP2FAAHNAAADNM1EPHX2
SCHEMBL20542645 1.00 CASP2 (0.83) CASP2FAAHNAAADNM1EPHX2
SCHEMBL21633848 1.00 CASP2 (0.83) CASP2FAAHNAAADNM1EPHX2

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
EP-3470391-A1 COSMETIC BASE INCLUDING AMIDE ALCOHOL ESTER, AND COSMETIC Kokyu Alcohol Kogyo Co., Ltd. (JP) 2019-04-17 — — EP disclosed
US-10017527-B2 KLK4 inhibitors UNIVERSITEIT ANTWERPEN (BE) 2018-07-10 — — US disclosed
US-20170101427-A1 NOVEL KLK4 INHIBITORS UNIVERSITEIT ANTWERPEN (BE) 2017-04-13 — — 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 (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-10017527-B2 KLK4 inhibitors KLK4, KLK3, KLK1 CASP2 1670/4885FAAH 4571/4885NAAA 2007/4885
US-20170101427-A1 NOVEL KLK4 INHIBITORS KLK4, KLK3, KLK1 CASP2 1531/4885FAAH 4623/4885NAAA 2177/4885

“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.

Send feedback