SCHEMBL19924306

SCHEMBL19924306

C=C(C)C(=O)OC1(C)CC2CCCC(C2)C1

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SCN1A P35498 1/20 0.36
SCN2A Q99250 1/20 0.36
SCN3A Q9NY46 1/20 0.36
ALDH1A1 P00352 2/20 0.32

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
SCHEMBL19187222 0.88 SCN1A (0.36) SCN1ASCN2ASCN3A
SCHEMBL25120521 0.83 SCN1A (0.36) SCN1ASCN2ASCN3AALDH1A1
SCHEMBL16016386 0.83 SCN1A (0.36) SCN1ASCN2ASCN3AALDH1A1
SCHEMBL19718999 0.81 ALDH1A1 (0.31) ALDH1A1
SCHEMBL26082480 0.81 APLNR (0.36) SCN1ASCN2ASCN3AALDH1A1
SCHEMBL12552876 0.80 ALDH1A1 (0.32) ALDH1A1
SCHEMBL25518517 0.78 ALDH1A1 (0.31) SCN1ASCN2ASCN3AALDH1A1
SCHEMBL11230563 0.77 ALDH1A1 (0.35) ALDH1A1
SCHEMBL18469320 0.77 ALDH1A1 (0.30) ALDH1A1
SCHEMBL22811600 0.77 ALDH1A1 (0.30) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180059545-A1 MONOMERS, POLYMERS AND PHOTORESIST COMPOSITIONS DUPONT SPECIALTY MATERIALS KOREA LTD (KR) 2018-03-01 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-20180059545-A1 MONOMERS, POLYMERS AND PHOTORESIST COMPOSITIONS PARG, LCP1, ALG3 SCN1A 3940/4885SCN2A 4225/4885SCN3A 4339/4885

“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.