SCHEMBL31010376

SCHEMBL31010376

Cn1ccc(C23CC(C2)C3)n1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.36
KMT2A Q03164 2/20 0.36
ALDH1A1 P00352 2/20 0.36
MEN1 O00255 1/20 0.36
DDB1 Q16531 2/20 0.35
CRBN Q96SW2 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HSD11B1 P28845 1/20 0.35
KEAP1 Q14145 1/20 0.33
OPRM1 P35372 1/20 0.32
OPRL1 P41146 1/20 0.32
KDM1A O60341 1/20 0.31
HTR6 P50406 1/20 0.30

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
SCHEMBL5029515 0.92 KDM4E (0.44) KDM4EKMT2AALDH1A1MEN1DDB1
SCHEMBL14859444 0.79 HSD11B1 (0.37) KDM4EKMT2AALDH1A1MEN1HSD11B1
SCHEMBL31010265 0.76 EPHX2 (0.42) KDM4EKMT2AALDH1A1MEN1SMN1; SMN2
SCHEMBL2629313 0.67 BCHE (0.35) KDM4EKMT2AALDH1A1DDB1CRBN
SCHEMBL2767111 0.65 ALDH1A1 (0.40) KDM4EKMT2AALDH1A1MEN1SMN1; SMN2
SCHEMBL20260854 0.65 KDM1A (0.36) KDM4EKMT2AALDH1A1DDB1CRBN
SCHEMBL31010375 0.63 DDB1 (0.44) KDM4EKMT2AALDH1A1DDB1CRBN
SCHEMBL2767113 0.63 ALDH1A1 (0.38) KDM4EKMT2AALDH1A1MEN1SMN1; SMN2
SCHEMBL31289282 0.62 P2RX7 (0.32) KMT2ADDB1CRBNSMN1; SMN2OPRM1
SCHEMBL31010284 0.62 DDB1 (0.43) KMT2ADDB1CRBNSMN1; SMN2KEAP1

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-20240252473-A1 Sulfoximines as inhibitors of NaV1.8 GRUENENTHAL GMBH (DE) 2024-08-01 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-20240252473-A1 Sulfoximines as inhibitors of NaV1.8 SCN8A, SCN10A, SCN7A KDM4E 3842/4885KMT2A 2923/4885ALDH1A1 915/4885

“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.