SCHEMBL22147494

SCHEMBL22147494

N#Cc1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)cc1N1c2ccccc2C2(c3ccccc3Oc3ccccc32)c2ccccc21

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.34
ALDH1A1 P00352 4/20 0.33
KDM4E B2RXH2 2/20 0.33
LMNA P02545 2/20 0.33
RXFP1 Q9HBX9 1/20 0.33
THRB P10828 1/20 0.33
ADORA2A P29274 1/20 0.33
ADORA1 P30542 1/20 0.33
ABCG2 Q9UNQ0 5/20 0.33
CYP11B1 P15538 2/20 0.31
CYP11B2 P19099 2/20 0.31
HPGD P15428 2/20 0.30
SMN1; SMN2 Q16637 2/20 0.30
MAPK1 P28482 1/20 0.30
HIF1A Q16665 1/20 0.30
ABCB1 P08183 1/20 0.30

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
SCHEMBL22147697 0.91 ALDH1A1 (0.33) HTTALDH1A1KDM4ELMNARXFP1
SCHEMBL22147651 0.88 CYP1A2 (0.32) HTTALDH1A1ADORA2AADORA1ABCG2
SCHEMBL22147914 0.88 ALDH1A1 (0.35) HTTALDH1A1KDM4ELMNARXFP1
SCHEMBL22147493 0.88 ALDH1A1 (0.38) HTTALDH1A1KDM4ELMNARXFP1
SCHEMBL22147500 0.86 HTT (0.33) HTTALDH1A1KDM4ELMNARXFP1
SCHEMBL22147495 0.85 ALDH1A1 (0.33) HTTALDH1A1KDM4ELMNARXFP1
SCHEMBL22147686 0.85 SMN1; SMN2 (0.34) HTTKDM4EABCG2SMN1; SMN2HIF1A
SCHEMBL22147589 0.84 ALDH1A1 (0.33) HTTALDH1A1LMNAADORA2AADORA1
SCHEMBL22147628 0.84 ALDH1A1 (0.32) HTTALDH1A1LMNAADORA2AADORA1
SCHEMBL22147915 0.82 ALDH1A1 (0.32) HTTALDH1A1KDM4ELMNARXFP1

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-20200199149-A1 ORGANIC COMPOUND, ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DEVICE HAVING THE COMPOUND LG DISPLAY CO., LTD. (KR) 2020-06-25 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-20200199149-A1 ORGANIC COMPOUND, ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DEVICE HAVING THE COMPOUND OCIAD1, OSTC, OCIAD2 HTT 1359/4885ALDH1A1 104/4885KDM4E 3675/4885

“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.