SCHEMBL6327342

SCHEMBL6327342

CO/N=C(\N)N(CCN(Cc1ccc(OCc2ccccc2)c(OC)c1)C(=O)C(C)C)c1ccc(Cl)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 2/20 0.49
RAF1 P04049 6/20 0.45
MAP2K1 Q02750 6/20 0.45
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
KDM4E B2RXH2 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
BLM P54132 1/20 0.44
MRGPRX4 Q96LA9 1/20 0.43
APP P05067 1/20 0.42
ALDH1A1 P00352 3/20 0.40
LMNA P02545 3/20 0.40
HTT P42858 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
NPC1 O15118 3/20 0.40
MAPT P10636 3/20 0.40
RAB9A P51151 3/20 0.40

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
SCHEMBL6327346 0.86 TRPM8 (0.51) TRPM8RAF1MAP2K1MEN1KMT2A
SCHEMBL6648580 0.82 TRPM8 (0.49) TRPM8RAF1MAP2K1MEN1KMT2A
SCHEMBL6324716 0.80 TRPM8 (0.47) TRPM8RAF1MAP2K1MEN1KMT2A
SCHEMBL6327033 0.79 TRPM8 (0.72) TRPM8RAF1MAP2K1MEN1KMT2A
SCHEMBL6322783 0.77 TRPM8 (0.52) TRPM8RAF1MAP2K1MEN1KMT2A
SCHEMBL6324719 0.77 TRPM8 (0.49) TRPM8RAF1MAP2K1MEN1KMT2A
SCHEMBL6322780 0.75 TRPM8 (0.49) TRPM8RAF1MAP2K1MEN1KMT2A
SCHEMBL6326223 0.73 TRPM8 (0.56) TRPM8RAF1MAP2K1MEN1KMT2A
SCHEMBL14078310 0.72 TRPM8 (0.62) TRPM8RAF1MAP2K1MEN1KMT2A
SCHEMBL9416658 0.70 MEN1 (0.61) TRPM8RAF1MAP2K1MEN1KMT2A

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-20050228017-A1 Novel anticancer compounds MORPHOCHEM AKTIENGESELLSCHAFT FUR KOMBINATORISCHE CHEMIE 2005-10-13 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-20050228017-A1 Novel anticancer compounds TP53, ABCG2, MCL1 TRPM8 2570/4885RAF1 660/4885MAP2K1 4672/4885

“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.