SCHEMBL7205287

SCHEMBL7205287

COc1cc(C=CC=C(C#N)NCCc2ccccc2)c(OC)cc1O

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
MAOB P27338 2/20 0.47
MAOA P21397 1/20 0.47
ALOX5 P09917 1/20 0.43
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KDM4E B2RXH2 1/20 0.41
GFER P55789 1/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
TAAR1 Q96RJ0 1/20 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
SCHEMBL7204118 0.83 MEN1 (0.61) MAPTMEN1KMT2AMAOBMAOA
SCHEMBL7205283 0.78 KMT2A (0.56) MAPTMEN1KMT2AALDH1A1HPGD
SCHEMBL7166665 0.77 MAPT (0.54) MAPTMEN1KMT2AMAOBALOX5
SCHEMBL7191088 0.74 NFE2L2 (0.38) MAPTMEN1KMT2AMAOBALDH1A1
SCHEMBL7191091 0.74 NFE2L2 (0.38) MAPTMEN1KMT2AMAOBALDH1A1
SCHEMBL13678101 0.72 MAOB (0.78) MAPTMEN1KMT2AMAOBMAOA
SCHEMBL7205277 0.72 SLC16A3 (0.40) MAPTMEN1KMT2AALDH1A1HPGD
SCHEMBL6030512 0.69 MEN1 (0.78) MAPTMEN1KMT2AMAOBALOX5
SCHEMBL4483006 0.69 MEN1 (0.78) MAPTMEN1KMT2AMAOBALOX5
SCHEMBL6028906 0.67 MAOB (0.71) MAPTMEN1KMT2AMAOBMAOA

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-20030109502-A1 Novel compounds for modulating cell proliferation HSC RESEARCH AND DEVELOPMENT LIMITED PARTNERSHIP (CA) 2003-06-12 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-20030109502-A1 Novel compounds for modulating cell proliferation MKI67, CCNA1, CCNI MAPT 4740/4885MEN1 1705/4885KMT2A 3487/4885

“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.