SCHEMBL26569892

SCHEMBL26569892

Cn1ccc2c3ccn(C)c3ccc21

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.50
ALDH1A1 P00352 1/20 0.50
MAPT P10636 1/20 0.50
RXFP1 Q9HBX9 1/20 0.50
NQO2 P16083 1/20 0.48
DHFR P00374 1/20 0.47
PRKCI P41743 1/20 0.44
RHEB Q15382 1/20 0.44
CYP2A6 P11509 2/20 0.40
GPR3 P46089 1/20 0.39
HSD11B1 P28845 4/20 0.39
ASH1L Q9NR48 1/20 0.37
PIK3CB P42338 1/20 0.35
PTPN1 P18031 2/20 0.35
GPR84 Q9NQS5 1/20 0.34

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
SCHEMBL12278359 0.94 KDM4E (0.46) KDM4EALDH1A1MAPTRXFP1NQO2
SCHEMBL822778 0.82 ALDH1A1 (0.52) KDM4EALDH1A1MAPTRXFP1NQO2
SCHEMBL14502422 0.80 KDM4E (0.41) KDM4EALDH1A1MAPTRXFP1NQO2
SCHEMBL18527173 0.78 RHEB (0.47) KDM4EALDH1A1MAPTRXFP1NQO2
SCHEMBL14444124 0.78 NOTUM (0.55) KDM4EALDH1A1MAPTRXFP1NQO2
SCHEMBL12278227 0.77 HSD17B10 (0.42) KDM4EALDH1A1MAPTRXFP1NQO2
SCHEMBL5354038 0.77 KDM4E (0.38) KDM4EALDH1A1MAPTRXFP1NQO2
SCHEMBL21757326 0.77 NQO2 (0.55) KDM4EALDH1A1MAPTRXFP1NQO2
SCHEMBL31036090 0.77 DHFR (0.45) KDM4EALDH1A1MAPTRXFP1NQO2
SCHEMBL21603427 0.77 DHFR (0.45) KDM4EALDH1A1MAPTRXFP1NQO2

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-20230337525-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2023-10-19 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-20230337525-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD1, OCIAD2, OXER1 KDM4E 2033/4885ALDH1A1 60/4885MAPT 773/4885

“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.