SCHEMBL20127752

SCHEMBL20127752

Cc1nc2ccccc2n1-c1ccc(-c2c3ccccc3c(-c3ccc4c(c3)oc3cc5ccccc5cc34)c3ccccc23)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.47
HTT P42858 1/20 0.47
ALDH1A1 P00352 1/20 0.39
KDM4E B2RXH2 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HSD17B10 Q99714 1/20 0.37
TSHR P16473 1/20 0.37
NR1H2 P55055 1/20 0.37
NR1H3 Q13133 1/20 0.37
CYP1A2 P05177 1/20 0.36
PDE10A Q9Y233 1/20 0.36
PIK3CD O00329 2/20 0.35
PIK3CA P42336 2/20 0.35
MTOR P42345 1/20 0.35
ESR1 P03372 2/20 0.35
ESR2 Q92731 2/20 0.35
PTAFR P25105 1/20 0.35
PIK3CB P42338 1/20 0.35
PIK3CG P48736 1/20 0.35
POLB P06746 1/20 0.35

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
SCHEMBL17246877 0.94 MAPK1 (0.47) MAPK1HTTALDH1A1KDM4ESMN1; SMN2
SCHEMBL21392584 0.92 MAPK1 (0.50) MAPK1HTTALDH1A1KDM4ESMN1; SMN2
SCHEMBL22218980 0.91 MAPK1 (0.46) MAPK1HTTALDH1A1KDM4ESMN1; SMN2
SCHEMBL20127747 0.89 PDE10A (0.39) MAPK1HTTALDH1A1KDM4ESMN1; SMN2
SCHEMBL20127749 0.88 ESR1 (0.49) MAPK1HTTALDH1A1KDM4EESR1
SCHEMBL21392595 0.88 MAPK1 (0.50) MAPK1HTTALDH1A1KDM4ESMN1; SMN2
SCHEMBL21392677 0.88 MAPK1 (0.45) MAPK1HTTALDH1A1KDM4ESMN1; SMN2
SCHEMBL20127751 0.87 ESR1 (0.44) MAPK1HTTALDH1A1ESR1ESR2
SCHEMBL26345591 0.85 MAPK1 (0.47) MAPK1HTTALDH1A1KDM4ESMN1; SMN2
SCHEMBL22217560 0.84 MAPK1 (0.46) MAPK1HTTALDH1A1KDM4ESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180130968-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2018-05-10 US disclosed
US-20180130968-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2018-05-10 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-20180130968-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND ELECTRONIC DEVICE RER1, NR0B1, NR2E1 MAPK1 1035/4885HTT 4764/4885ALDH1A1 476/4885

“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.