SCHEMBL21476601

SCHEMBL21476601

c1ccc(-c2nc(-c3cc4ccccc4o3)nc(-c3c4ccccc4c(-c4ccccc4)c4ccccc34)n2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.43
MAOA P21397 2/20 0.43
MAPT P10636 3/20 0.41
KDM4E B2RXH2 3/20 0.41
ALDH1A1 P00352 2/20 0.41
TSHR P16473 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
HSD17B10 Q99714 1/20 0.41
RAB9A P51151 6/20 0.40
NPC1 O15118 4/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
ALOX5 P09917 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
CYP19A1 P11511 2/20 0.39
ESR1 P03372 2/20 0.39
ESR2 Q92731 2/20 0.39
GABRP O00591 1/20 0.39
GABRD O14764 1/20 0.39
CA12 O43570 1/20 0.39

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
SCHEMBL21476799 0.97 MAOB (0.43) MAOBMAOAMAPTKDM4EALDH1A1
SCHEMBL21476574 0.96 MAOB (0.46) MAOBMAOAMAPTKDM4EALDH1A1
SCHEMBL21476470 0.94 MAOB (0.45) MAOBMAOAMAPTKDM4EALDH1A1
SCHEMBL21476828 0.92 MAOB (0.43) MAOBMAOAMAPTKDM4EALDH1A1
SCHEMBL24226005 0.92 MAOB (0.44) MAOBMAOAMAPTKDM4EALDH1A1
SCHEMBL21476588 0.91 MAOB (0.40) MAOBMAOAMAPTKDM4EALDH1A1
SCHEMBL21476823 0.89 KDM4E (0.43) MAOBMAOAMAPTKDM4EALDH1A1
SCHEMBL21476800 0.89 PLA2G2A (0.43) MAOBMAOAMAPTKDM4EALDH1A1
SCHEMBL21476801 0.89 PLA2G2A (0.43) MAOBMAOAMAPTKDM4EALDH1A1
SCHEMBL21476776 0.88 RAB9A (0.41) MAOBMAOAMAPTKDM4EALDH1A1

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-20210130336-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2021-05-06 US disclosed
WO-2019198806-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 出光興産株式会社 2019-10-17 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-20210130336-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE L1CAM, MLX, LEF1 MAOB 2115/4885MAOA 1700/4885MAPT 1924/4885

“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.