SCHEMBL11203642

SCHEMBL11203642

O=[N+]([O-])C1=C(Cl)C=CCC1

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.30
TSHR P16473 2/20 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
SCHEMBL15711352 0.75
SCHEMBL30349823 0.75 ALDH1A1 (0.32) ALDH1A1TSHR
SCHEMBL15003547 0.75
SCHEMBL8312472 0.73 ALDH1A1 (0.35) ALDH1A1TSHR
SCHEMBL30349850 0.71 ALDH1A1 (0.32) ALDH1A1
SCHEMBL20977414 0.71
SCHEMBL19308518 0.71
SCHEMBL18434778 0.71
SCHEMBL24488665 0.68
SCHEMBL20977296 0.68 LMNA (0.34)

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
CN-115867277-A Novel fused heterocyclyl-carbohydrazone acyldinitrile compounds and use thereof 韩国科学技术研究院 2023-03-28 CN disclosed
EP-0079683-A2 Herbicidal sulfonamides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1983-05-25 EP disclosed