SCHEMBL29284867

SCHEMBL29284867

C=COC1CC(OCc2ccccc2)C1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 1/20 0.45
▸ CTSB P07858 1/20 0.45
▸ CTSK P43235 1/20 0.45
▸ NAAA Q02083 4/20 0.42
▸ OPRM1 P35372 2/20 0.41
▸ OPRL1 P41146 2/20 0.41
▸ DPP4 P27487 1/20 0.41
▸ TMEM97 Q5BJF2 1/20 0.39
▸ CARM1 Q86X55 1/20 0.39
▸ PRMT6 Q96LA8 1/20 0.39
▸ SIGMAR1 Q99720 1/20 0.39
▸ PRMT8 Q9NR22 1/20 0.39
▸ HRH3 Q9Y5N1 1/20 0.39
▸ BCHE P06276 1/20 0.39
▸ TSHR P16473 1/20 0.38
▸ SLC18A3 Q16572 1/20 0.36
▸ AGTR2 P50052 2/20 0.36

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
SCHEMBL20121044 0.83 CTSL (0.45) CTSLCTSBCTSKNAAAOPRM1
SCHEMBL20121045 0.83 CTSL (0.45) CTSLCTSBCTSKNAAAOPRM1
SCHEMBL2650237 0.83 CTSL (0.45) CTSLCTSBCTSKNAAAOPRM1
SCHEMBL989623 0.78 CTSL (0.50) CTSLCTSBCTSKNAAAOPRM1
SCHEMBL11023393 0.78 CTSL (0.50) CTSLCTSBCTSKNAAAOPRM1
SCHEMBL29260378 0.78 CTSL (0.50) CTSLCTSBCTSKNAAAOPRM1
SCHEMBL23192139 0.77 CTSL (0.43) CTSLCTSBCTSKNAAAOPRM1
SCHEMBL21947282 0.77 CTSL (0.43) CTSLCTSBCTSKNAAAOPRM1
SCHEMBL21390121 0.77 CTSL (0.49) CTSLCTSBCTSKNAAAOPRM1
SCHEMBL23294685 0.77 CTSL (0.49) CTSLCTSBCTSKNAAAOPRM1

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
CN-118251393-A Novel substituted sulfonylurea compounds as inhibitors of interleukin-1 activity 唯久生物技术(苏州)有限公司 2024-06-25 — — CN disclosed
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