SCHEMBL5810312

SCHEMBL5810312

CCOC(=O)c1cc(C)nc2ccccc12

nearest known ligand 0.72

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 11/20 0.72
MEN1 O00255 1/20 0.67
KMT2A Q03164 1/20 0.67
ALDH1A1 P00352 4/20 0.64
MAPK1 P28482 3/20 0.64
LMNA P02545 2/20 0.61
CYP1A2 P05177 1/20 0.61
CYP3A4 P08684 1/20 0.61
HPGD P15428 1/20 0.61
CYP2C19 P33261 1/20 0.61
HTT P42858 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
PKM P14618 1/20 0.61
MAPT P10636 1/20 0.60
HSD17B10 Q99714 1/20 0.60
GAA P10253 1/20 0.58

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
SCHEMBL31133520 1.00 KDM4E (0.72) KDM4EMEN1KMT2AALDH1A1MAPK1
SCHEMBL2918797 0.88 KDM4E (0.67) KDM4EMEN1KMT2AALDH1A1MAPK1
SCHEMBL1636608 0.88 ATM (0.72) KDM4EMEN1KMT2AALDH1A1MAPK1
SCHEMBL3330317 0.85 ALDH1A1 (0.60) KDM4EMEN1KMT2AALDH1A1MAPK1
SCHEMBL8562988 0.85 KDM4E (0.72) KDM4EMEN1KMT2AALDH1A1MAPK1
SCHEMBL31295407 0.84 KDM4E (0.70) KDM4EMEN1KMT2AALDH1A1MAPK1
SCHEMBL12903095 0.84 KDM4E (0.70) KDM4EMEN1KMT2AALDH1A1MAPK1
SCHEMBL10678483 0.84 KDM4E (0.79) KDM4EMEN1KMT2AALDH1A1MAPK1
SCHEMBL31531878 0.84 KDM4E (0.79) KDM4EMEN1KMT2AALDH1A1MAPK1
SCHEMBL13576788 0.83 KDM4E (0.55) KDM4EMEN1KMT2AALDH1A1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023205458-A2 FORMULATIONS FOR REPELLING BEES AND OTHER INSECTS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-10-26 WO disclosed
US-9249163-B2 PDE10a inhibitors for the treatment of type II diabetes JANSSEN PHARMACEUTICA NV. (BE) 2016-02-02 US disclosed
US-20140364414-A1 PDE 10a Inhibitors for the Treatment of Type II Diabetes JANSSEN PHARMACEUTICA, NV (BE) 2014-12-11 US disclosed
WO-2006136008-A1 SALICYLIC ACID HYDRAZONES AS INHIBITORS OF THE ERK MAPKINASE PATHWAY AND FOR THE TREATMENT OF CANCER UNIVERSITY HEALTH NETWORK (CA) 2006-12-28 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-20140364414-A1 PDE 10a Inhibitors for the Treatment of Type II Diabetes PDE2A, PDE3B, PDE3A KDM4E 1186/4885MEN1 3624/4885KMT2A 1978/4885

“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.