SCHEMBL22435596

SCHEMBL22435596

CCC(C)c1cscc1OC

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.35
MAPT P10636 2/20 0.32
ALDH1A1 P00352 2/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
ALOX12 P18054 1/20 0.32
TAAR1 Q96RJ0 1/20 0.31
KDM4E B2RXH2 1/20 0.31
GAA P10253 1/20 0.31
RORC P51449 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
SCHEMBL22426583 0.84 TSHR (0.35) TSHRMAPTALDH1A1KDM4EGAA
SCHEMBL23317660 0.79 TOP1 (0.37) LMNA
SCHEMBL12009461 0.79 GAA (0.38) GAA
SCHEMBL8261529 0.75 MGAM (0.37) LMNAGAA
SCHEMBL20154933 0.74 TSHR (0.40) TSHRRORC
SCHEMBL22432025 0.73 TOP1 (0.34) TSHR
SCHEMBL14765667 0.72 TSHR (0.39) TSHRRORC
SCHEMBL19314294 0.71 TSHR (0.57) TSHRALDH1A1TP53KDM4E
SCHEMBL23332701 0.71 TSHR (0.38) TSHRRORC
SCHEMBL22426458 0.71 TSHR (0.38) TSHRRORC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11377422-B2 Charged ion channel blockers and methods for use Nocion Therapeutics, Inc. (US) 2022-07-05 US disclosed
US-20200290965-A1 CHARGED ION CHANNEL BLOCKERS AND METHODS FOR USE Nocion Therapeutics, Inc. 2020-09-17 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-11377422-B2 Charged ion channel blockers and methods for use TRPV1, TRPV2, TRPV5 TSHR 4055/4885MAPT 1799/4885ALDH1A1 2736/4885
US-20200290965-A1 CHARGED ION CHANNEL BLOCKERS AND METHODS FOR USE TRPV1, TRPV2, TRPV5 TSHR 4055/4885MAPT 1799/4885ALDH1A1 2736/4885

“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.