SCHEMBL23379151

SCHEMBL23379151

CC(C)c1c2c(c(C(N)=O)c3c1CCCC3)CCCC2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.42
▸ MAPT P10636 4/20 0.42
▸ HPGD P15428 4/20 0.42
▸ KDM4E B2RXH2 4/20 0.42
▸ HSD17B10 Q99714 4/20 0.42
▸ USP2 O75604 1/20 0.42
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ ALOX15 P16050 3/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ FLT3 P36888 10/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ RECQL P46063 1/20 0.38
▸ NPC1 O15118 2/20 0.38
▸ RAB9A P51151 2/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ TSHR P16473 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ ANO1 Q5XXA6 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
SCHEMBL21646791 0.78 LDHA (0.41) MAPTHPGDKDM4EMEN1KMT2A
SCHEMBL23379153 0.77 USP2 (0.44) ALDH1A1MAPTHPGDKDM4EHSD17B10
SCHEMBL23957355 0.73 MAPT (0.41) ALDH1A1MAPTHPGDKDM4EHSD17B10
SCHEMBL24526948 0.72 ACHE (0.41) ALDH1A1KDM4EMEN1KMT2AMAPK1
SCHEMBL14726027 0.69 ALDH1A1 (0.60) ALDH1A1MAPTHPGDKDM4EHSD17B10
SCHEMBL23957356 0.68 ALDH1A1 (0.42) ALDH1A1MAPTHPGDKDM4EHSD17B10
SCHEMBL14655346 0.67 POLB (0.42) ALDH1A1MAPTHPGDKDM4EHSD17B10
SCHEMBL19869243 0.67 — —
SCHEMBL8249959 0.67 ALDH1A1 (0.44) ALDH1A1MAPTHPGDKDM4EHSD17B10
SCHEMBL21646783 0.65 RXRA (0.34) KDM4EMEN1KMT2ACYP1A2CYP2C19

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 ALDH1A1 3547/4885MAPT 790/4885HPGD 2714/4885

“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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