SCHEMBL18412666

SCHEMBL18412666

COC[C@H](NCCCNC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)C(N)=O

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.35
▸ USP2 O75604 1/20 0.30
▸ SLCO1B1 Q9Y6L6 1/20 0.30

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
SCHEMBL19750583 0.85 KDM4E (0.42) KDM4EUSP2SLCO1B1
SCHEMBL18412668 0.80 REN (0.30) —
SCHEMBL18412671 0.76 KDM4E (0.32) KDM4E
SCHEMBL8376708 0.76 KDM4E (0.47) KDM4E
SCHEMBL19873268 0.76 KDM4E (0.47) KDM4E
SCHEMBL10337937 0.73 KDM4E (0.54) KDM4EUSP2SLCO1B1
SCHEMBL11411891 0.73 KDM4E (0.42) KDM4E
SCHEMBL29289096 0.72 KDM4E (0.50) KDM4EUSP2SLCO1B1
SCHEMBL8378527 0.72 KDM4E (0.50) KDM4EUSP2SLCO1B1
SCHEMBL22096301 0.71 KDM4E (0.42) KDM4EUSP2SLCO1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180092915-A1 SODIUM CHANNEL BLOCKERS FOR SKIN DISORDERS PARION SCIENCES, INC. (US) 2018-04-05 — — US disclosed
US-20180092915-A1 SODIUM CHANNEL BLOCKERS FOR SKIN DISORDERS PARION SCIENCES, INC. (US) 2018-04-05 — — US disclosed
US-9849129-B2 Sodium channel blockers for skin disorders PARION SCIENCES, INC. (US) 2017-12-26 — — US disclosed
US-9849129-B2 Sodium channel blockers for skin disorders PARION SCIENCES, INC. (US) 2017-12-26 — — US disclosed
US-20170020870-A1 SODIUM CHANNEL BLOCKERS FOR SKIN DISORDERS PARION SCIENCES, INC. 2017-01-26 — — 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-20180092915-A1 SODIUM CHANNEL BLOCKERS FOR SKIN DISORDERS SCNN1B, SCNN1A, SCNN1G KDM4E 3964/4885USP2 2929/4885SLCO1B1 1097/4885
US-20170020870-A1 SODIUM CHANNEL BLOCKERS FOR SKIN DISORDERS SCNN1B, SCNN1A, SCNN1G KDM4E 3964/4885USP2 2929/4885SLCO1B1 1097/4885

“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