SCHEMBL24029347

SCHEMBL24029347

CCCC(C)(C)OCCC(C)(C)n1cc(CN2CCS(=O)(=O)CC2)nn1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C19 P33261 1/20 0.38
MEN1 O00255 1/20 0.32
NPC1 O15118 2/20 0.31
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.31
RAB9A P51151 1/20 0.31
ALDH1A1 P00352 1/20 0.30
HRH4 Q9H3N8 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
SCHEMBL22138141 0.90 KMT2A (0.36) KMT2ACYP1A2CYP2C19MEN1
SCHEMBL20988715 0.88 KMT2A (0.35) KMT2ACYP1A2CYP2C19MEN1NPC1
SCHEMBL22209541 0.87 CYP1A2 (0.33) KMT2ACYP1A2CYP2C19
SCHEMBL19734913 0.85 CYP1A2 (0.33) KMT2ACYP1A2CYP2C19KDM4ERAB9A
SCHEMBL19708674 0.82 CYP1A2 (0.31) KMT2ACYP1A2CYP2C19
SCHEMBL24379650 0.81 CYP1A2 (0.33) KMT2ACYP1A2CYP2C19
SCHEMBL21093199 0.70 CYP19A1 (0.33)
SCHEMBL24333892 0.69
SCHEMBL14022378 0.68 KMT2A (0.49) KMT2ACYP1A2CYP2C19MEN1NPC1
SCHEMBL20118277 0.68 KMT2A (0.35) KMT2ACYP1A2CYP2C19MEN1NPC1

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-20210353781-A1 SURFACE-MODIFIED CELLS, METHODS OF MAKING AND USING UNITED STATES GOVERNMENT 2021-11-18 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-20210353781-A1 SURFACE-MODIFIED CELLS, METHODS OF MAKING AND USING CD4, EPCAM, CD2 KMT2A 2158/4885CYP1A2 4884/4885CYP2C19 4870/4885

“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.