SCHEMBL17377367

SCHEMBL17377367

Oc1ccc(Nc2noc(-c3ccc(Cl)cc3)n2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.48
ALOX5 P09917 2/20 0.48
VCP P55072 2/20 0.48
MAPKAPK2 P49137 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
DEGS1 O15121 1/20 0.48
MAP4K4 O95819 1/20 0.48
CYP3A4 P08684 1/20 0.48
AMY1A P0DUB6 1/20 0.48
ALOX15 P16050 1/20 0.48
TSHR P16473 1/20 0.48
MAPK1 P28482 1/20 0.48
PIM3 Q86V86 1/20 0.48
MINK1 Q8N4C8 1/20 0.48
SPHK2 Q9NRA0 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
SPHK1 Q9NYA1 1/20 0.48
NOTUM Q6P988 1/20 0.48
AURKA O14965 1/20 0.46

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
SCHEMBL26095552 0.78 NR1H4 (0.70) MAPTMEN1KMT2ANOTUMNR1H4
SCHEMBL19075472 0.76 RAB9A (0.51) MAPTMEN1KMT2ACYP3A4TSHR
SCHEMBL17377369 0.73 VCP (0.55) MAPTALOX5VCPMAPKAPK2MEN1
SCHEMBL11080475 0.73 MEN1 (0.53) MAPTMEN1KMT2ACYP3A4GAA
SCHEMBL3532271 0.72 SPHK2 (0.74) VCPMEN1KMT2AMAPK1SPHK2
SCHEMBL20968220 0.72 NR1H4 (0.59) MAPTMEN1KMT2ACYP3A4MAPK1
SCHEMBL17377392 0.72 SPHK2 (0.74) VCPMEN1KMT2AMAPK1SPHK2
SCHEMBL4416547 0.71 CASP3 (0.62) MAPTMEN1KMT2AGAANPC1
SCHEMBL11156115 0.71 GSK3B (0.53) MAPTALOX5VCPMAPKAPK2MEN1
SCHEMBL27643199 0.71 PIK3CA (0.74) MAPTALOX5VCPMAPKAPK2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9828351-B2 Enzyme interacting agents MONASH UNIVERSITY (AU) 2017-11-28 US disclosed
US-9828351-B2 Enzyme interacting agents MONASH UNIVERSITY (AU) 2017-11-28 US disclosed
US-20170190698-A1 ENZYME INTERACTING AGENTS CENTRAL ADELAIDE LOCAL HEALTH NETWORK INCORPORATED (AU) 2017-07-06 US disclosed
US-20170190698-A1 ENZYME INTERACTING AGENTS CENTRAL ADELAIDE LOCAL HEALTH NETWORK INCORPORATED (AU) 2017-07-06 US disclosed
US-20170190698-A1 ENZYME INTERACTING AGENTS CENTRAL ADELAIDE LOCAL HEALTH NETWORK INCORPORATED (AU) 2017-07-06 US disclosed
EP-3160949-A1 ENZYME INTERACTING AGENTS Monash University (AU) 2017-05-03 EP disclosed
WO-2015196258-A1 ENZYME INTERACTING AGENTS MONASH UNIVERSITY (AU) 2015-12-30 WO disclosed
WO-2015196258-A1 ENZYME INTERACTING AGENTS MONASH UNIVERSITY (AU) 2015-12-30 WO 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-20170190698-A1 ENZYME INTERACTING AGENTS SMPD1, SMPD2, ASAH1 MAPT 3836/4885ALOX5 466/4885VCP 988/4885

“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.