SCHEMBL31559331

SCHEMBL31559331

Cc1c(Cl)cccc1C1(NC(=O)CCl)CCCN(Cc2ccccc2)C1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CYP2D6 P10635 10/20 0.44
▸ ALDH1A1 P00352 5/20 0.44
▸ SIGMAR1 Q99720 2/20 0.43
▸ CYP3A4 P08684 8/20 0.41
▸ TSHR P16473 6/20 0.41
▸ SLC6A9 P48067 1/20 0.41
▸ USP2 O75604 1/20 0.41
▸ HDAC4 P56524 1/20 0.41
▸ RECQL P46063 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.40
▸ GAA P10253 1/20 0.40

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
SCHEMBL31559321 0.79 HDAC1 (0.42) —
SCHEMBL31559216 0.77 CYP2D6 (0.46) CYP2D6ALDH1A1CYP3A4TSHRUSP2
SCHEMBL31559381 0.77 CYP2D6 (0.45) CYP2D6ALDH1A1CYP3A4TSHRUSP2
SCHEMBL31559253 0.77 HDAC1 (0.45) ALDH1A1CYP3A4GAA
SCHEMBL2878982 0.77 SLC6A9 (0.51) CYP2D6ALDH1A1CYP3A4TSHRSLC6A9
SCHEMBL31559176 0.74 SIGMAR1 (0.35) CYP2D6ALDH1A1SIGMAR1CYP3A4TSHR
SCHEMBL31559814 0.72 CYP2D6 (0.37) CYP2D6ALDH1A1SIGMAR1CYP3A4TSHR
SCHEMBL19331000 0.70 PTGS2 (0.40) CYP2D6ALDH1A1SIGMAR1CYP3A4TSHR
SCHEMBL19343289 0.68 CYP2D6 (0.51) CYP2D6ALDH1A1CYP3A4TSHRSLC6A9
SCHEMBL19343573 0.67 SLC6A9 (0.50) CYP2D6ALDH1A1SIGMAR1CYP3A4TSHR

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
WO-2025090514-A1 COVALENT SARM1 INHIBITORS NURA BIO, INC. (US) 2025-05-01 — — WO disclosed
Send feedback