SCHEMBL22147697

SCHEMBL22147697

N#Cc1cc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)ccc1N1c2ccccc2C2(c3ccccc3Oc3ccccc32)c2ccccc21

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.33
HTT P42858 2/20 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
MEN1 O00255 2/20 0.32
TSHR P16473 2/20 0.32
KMT2A Q03164 2/20 0.32
HSD17B10 Q99714 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
NPC1 O15118 1/20 0.32
MAPT P10636 1/20 0.32
RAB9A P51151 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31

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
SCHEMBL22147494 0.91 HTT (0.34) ALDH1A1HTTKDM4ELMNARXFP1
SCHEMBL22147651 0.88 CYP1A2 (0.32) ALDH1A1HTTADORA2AADORA1NPSR1
SCHEMBL22147500 0.88 HTT (0.33) ALDH1A1HTTKDM4ELMNARXFP1
SCHEMBL22147499 0.88 ALDH1A1 (0.38) ALDH1A1HTTKDM4ELMNARXFP1
SCHEMBL22147698 0.88 TSHR (0.36) ALDH1A1HTTKDM4ELMNARXFP1
SCHEMBL22147694 0.85 ALDH1A1 (0.33) ALDH1A1HTTKDM4ELMNARXFP1
SCHEMBL22147716 0.85 ALDH1A1 (0.33) ALDH1A1HTTKDM4ELMNARXFP1
SCHEMBL22147686 0.85 SMN1; SMN2 (0.34) HTTKDM4ESMN1; SMN2ABCG2HIF1A
SCHEMBL22147628 0.84 ALDH1A1 (0.32) ALDH1A1HTTLMNAADORA2AADORA1
SCHEMBL22147510 0.83 ABCG2 (0.36) ALDH1A1HTTLMNAMEN1TSHR

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 ALDH1A1 104/4885HTT 1359/4885KDM4E 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.