SCHEMBL10076259

SCHEMBL10076259

CCc1ccc(C(=O)N2CCN(Cc3ccccc3)CC2)cc1

nearest known ligand 0.78

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.74
ALDH1A1 P00352 2/20 0.74
MAPK1 P28482 2/20 0.72
PKM P14618 1/20 0.72
MEN1 O00255 4/20 0.71
KMT2A Q03164 4/20 0.71
LMNA P02545 3/20 0.70
SMN1; SMN2 Q16637 3/20 0.68
TSHR P16473 1/20 0.68
L3MBTL1 Q9Y468 1/20 0.68
SIGMAR1 Q99720 1/20 0.67
CA12 O43570 1/20 0.66
CA1 P00915 1/20 0.66
CA2 P00918 1/20 0.66
CA7 P43166 1/20 0.66
CA9 Q16790 1/20 0.66
CA14 Q9ULX7 1/20 0.66
NPC1 O15118 1/20 0.65

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
SCHEMBL1019998 0.88 KDM4E (0.94) KDM4EALDH1A1MAPK1PKMMEN1
SCHEMBL9645824 0.88 KDM4E (0.94) KDM4EALDH1A1MAPK1PKMMEN1
SCHEMBL12452433 0.87 ALDH1A1 (0.76) KDM4EALDH1A1MAPK1PKMMEN1
SCHEMBL13149362 0.86 MEN1 (0.70) KDM4EALDH1A1MAPK1PKMMEN1
SCHEMBL13973503 0.85 LMNA (0.66) KDM4EALDH1A1MAPK1PKMMEN1
SCHEMBL13149349 0.85 KDM4E (0.78) KDM4EALDH1A1MAPK1MEN1KMT2A
SCHEMBL4486386 0.85 KDM4E (0.78) KDM4EALDH1A1MAPK1PKMMEN1
SCHEMBL25041158 0.84 KDM4E (0.76) KDM4EALDH1A1MAPK1PKMMEN1
SCHEMBL20121634 0.84 KDM4E (0.76) KDM4EALDH1A1MAPK1MEN1KMT2A
SCHEMBL4516322 0.84 KDM4E (0.76) KDM4EALDH1A1MAPK1PKMMEN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8093231-B2 Sulfonylethyl phosphorodiamidates TELIK, INC. (US) 2012-01-10 US disclosed
US-20080039429-A1 SULFONYLETHYL PHOSPHORODIAMIDATES TELIK, INC. 2008-02-14 US disclosed
US-7262182-B2 Sulfonylethyl phosphorodiamidates TELIK, INC. (US) 2007-08-28 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-20080039429-A1 SULFONYLETHYL PHOSPHORODIAMIDATES MTAP, TYMP, PHOSPHO1 KDM4E 958/4885ALDH1A1 4455/4885MAPK1 2187/4885

“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.