SCHEMBL23957355

SCHEMBL23957355

COC(=O)c1c2c(c(C(C)C)c3c1CCC3)CCC2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.41
▸ GAA P10253 6/20 0.41
▸ NPSR1 Q6W5P4 4/20 0.41
▸ LMNA P02545 4/20 0.41
▸ USP2 O75604 3/20 0.41
▸ ALDH1A1 P00352 12/20 0.40
▸ KDM4E B2RXH2 6/20 0.40
▸ HPGD P15428 5/20 0.40
▸ HSD17B10 Q99714 4/20 0.40
▸ MAPK1 P28482 2/20 0.40
▸ POLB P06746 1/20 0.40
▸ CASP1 P29466 2/20 0.39
▸ CASP7 P55210 2/20 0.39
▸ MCL1 Q07820 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ GPR55 Q9Y2T6 1/20 0.39
▸ CYP1A2 P05177 1/20 0.36
▸ CYP3A4 P08684 1/20 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
SCHEMBL23379153 0.96 USP2 (0.44) MAPTGAANPSR1LMNAUSP2
SCHEMBL24592591 0.80 USP2 (0.45) MAPTGAANPSR1USP2ALDH1A1
SCHEMBL21646791 0.79 LDHA (0.41) MAPTGAANPSR1LMNAKDM4E
SCHEMBL21626290 0.77 ALDH1A1 (0.48) MAPTGAANPSR1USP2ALDH1A1
SCHEMBL23379151 0.73 ALDH1A1 (0.42) MAPTUSP2ALDH1A1KDM4EHPGD
SCHEMBL22774938 0.71 ALDH1A1 (0.55) MAPTGAANPSR1LMNAUSP2
SCHEMBL23893927 0.71 — —
SCHEMBL19869243 0.69 — —
SCHEMBL22358990 0.67 TSHR (0.49) MAPTNPSR1ALDH1A1KDM4EHPGD
SCHEMBL3321873 0.67 ALDH1A1 (0.61) MAPTGAALMNAUSP2ALDH1A1

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-20210332020-A1 PHENYLSULFONYLUREA DERIVATIVES USEFUL AS NLRP3 INHIBITORS INFLAZOME LIMITED (IE) 2021-10-28 — — 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-20210332020-A1 PHENYLSULFONYLUREA DERIVATIVES USEFUL AS NLRP3 INHIBITORS NLRP3, NOD1, PYCARD MAPT 1671/4885GAA 2284/4885NPSR1 3168/4885

“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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