SCHEMBL23379153

SCHEMBL23379153

COC(=O)c1c2c(c(C(C)C)c3c1CCCC3)CCCC2

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 3/20 0.44
▸ ALDH1A1 P00352 7/20 0.43
▸ KDM4E B2RXH2 4/20 0.43
▸ MAPT P10636 6/20 0.42
▸ HPGD P15428 4/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ LMNA P02545 3/20 0.41
▸ NPSR1 Q6W5P4 2/20 0.41
▸ HSD17B10 Q99714 5/20 0.41
▸ GAA P10253 3/20 0.40
▸ CASP1 P29466 2/20 0.39
▸ CASP7 P55210 2/20 0.39
▸ MAPK10 P53779 1/20 0.39
▸ CNR2 P34972 1/20 0.38
▸ MAPK1 P28482 2/20 0.37
▸ TP53 P04637 1/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ POLB P06746 1/20 0.37

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
SCHEMBL23957355 0.96 MAPT (0.41) USP2ALDH1A1KDM4EMAPTHPGD
SCHEMBL23379151 0.77 ALDH1A1 (0.42) USP2ALDH1A1KDM4EMAPTHPGD
SCHEMBL24592591 0.76 USP2 (0.45) USP2ALDH1A1KDM4EMAPTHPGD
SCHEMBL21646791 0.75 LDHA (0.41) KDM4EMAPTHPGDSMN1; SMN2LMNA
SCHEMBL21626290 0.73 ALDH1A1 (0.48) USP2ALDH1A1KDM4EMAPTHPGD
SCHEMBL22774938 0.68 ALDH1A1 (0.55) USP2ALDH1A1KDM4EMAPTHPGD
SCHEMBL22358990 0.67 TSHR (0.49) ALDH1A1KDM4EMAPTHPGDSMN1; SMN2
SCHEMBL19140470 0.67 ALDH1A1 (0.66) USP2ALDH1A1KDM4EMAPTHPGD
SCHEMBL19140752 0.67 MAPK1 (0.44) USP2ALDH1A1KDM4EMAPTHPGD
SCHEMBL23893927 0.66 — —

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
US-20210147349-A1 PHENYLSULFONYLUREA DERIVATIVES USEFUL AS NLRP3 INHIBITORS INFLAZOME LIMITED (IE) 2021-05-20 — — 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 (1 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-20210147349-A1 PHENYLSULFONYLUREA DERIVATIVES USEFUL AS NLRP3 INHIBITORS NLRP3, NOD1, PYCARD USP2 533/4885ALDH1A1 3547/4885KDM4E 1448/4885

“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.

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