SCHEMBL15499078

SCHEMBL15499078

CCc1cc(NNc2ccc(S(=O)(=O)Nc3ccccn3)cc2)ccc1O

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.57
BRD4 O60885 6/20 0.57
KMT2A Q03164 2/20 0.57
ALDH1A1 P00352 2/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
MEN1 O00255 1/20 0.57
POLB P06746 2/20 0.54
ALOX12 P18054 1/20 0.53
LMNA P02545 2/20 0.52
PKM P14618 1/20 0.52
BRD3 Q15059 1/20 0.52
CREBBP Q92793 1/20 0.52
BRD7 Q9NPI1 1/20 0.52

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
SCHEMBL15499089 0.83 SLC7A11 (0.70) KDM4EBRD4KMT2AALDH1A1SMN1; SMN2
SCHEMBL15499090 0.82 ALDH1A1 (0.71) KDM4EBRD4KMT2AALDH1A1SMN1; SMN2
SCHEMBL15499088 0.80 BRD4 (0.71) KDM4EBRD4KMT2AALDH1A1SMN1; SMN2
SCHEMBL15499071 0.76 BRD4 (0.64) KDM4EBRD4KMT2AALDH1A1SMN1; SMN2
SCHEMBL15986425 0.75 KDM4E (0.70) KDM4EKMT2AALDH1A1SMN1; SMN2MEN1
SCHEMBL22679256 0.74 BRD4 (0.79) BRD4KMT2AALDH1A1MEN1LMNA
SCHEMBL547543 0.73 KDM4E (1.00) KDM4EKMT2AALDH1A1SMN1; SMN2MEN1
SCHEMBL15499066 0.72 SLC7A11 (0.58) KDM4EBRD4ALDH1A1POLBBRD3
SCHEMBL2243779 0.72 KDM4E (0.60) KDM4EKMT2AALDH1A1SMN1; SMN2MEN1
SCHEMBL10834280 0.72 BRD4 (0.74) BRD4KMT2AALDH1A1MEN1LMNA

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-20140066410-A1 INHIBITORS OF BROMODOMAINS AS MODULATORS OF GENE EXPRESSION ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) 2014-03-06 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-20140066410-A1 INHIBITORS OF BROMODOMAINS AS MODULATORS OF GENE EXPRESSION NFKBIA, NFKB2, IKBKG KDM4E 672/4885BRD4 23/4885KMT2A 1147/4885

“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.