SCHEMBL21476837

SCHEMBL21476837

c1ccc2oc(-c3ccc(-c4cc(-c5ccc(-c6cccc7ccccc67)cc5)nc(-c5ccc6c(c5)oc5ccccc56)n4)cc3)cc2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.44
PTPRC P08575 1/20 0.41
PTPN1 P18031 1/20 0.41
ENPP3 O14638 1/20 0.41
ENPP1 P22413 1/20 0.41
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
MAOA P21397 2/20 0.39
ALOX5 P09917 1/20 0.39
PLA2G2A P14555 2/20 0.38
PLA2G4A P47712 2/20 0.38
METAP2 P50579 1/20 0.38
RAB9A P51151 3/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
NPC1 O15118 2/20 0.38
CYP19A1 P11511 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL23335210 0.95 ENPP1 (0.41) MAOBPTPRCPTPN1ENPP3ENPP1
SCHEMBL21476634 0.93 MAOB (0.46) MAOBPTPRCPTPN1ENPP3ENPP1
SCHEMBL21476833 0.90 MAOB (0.41) MAOBPTPRCPTPN1ENPP3ENPP1
SCHEMBL21476563 0.90 MAOB (0.43) MAOBPTPRCPTPN1CA1CA2
SCHEMBL21476832 0.88 ALOX5 (0.44) MAOBPTPRCPTPN1ENPP3ENPP1
SCHEMBL23334660 0.88 PTPRC (0.40) MAOBPTPRCPTPN1ENPP3ENPP1
SCHEMBL23334982 0.88 METAP2 (0.42) MAOBPTPRCPTPN1CA1CA2
SCHEMBL21480652 0.88 MAOB (0.48) MAOBCA1CA2CA9MAOA
SCHEMBL19397395 0.88 ENPP1 (0.45) ENPP3ENPP1CA1CA2CA9
SCHEMBL21476552 0.86 PLA2G2A (0.48) MAOBCA1CA2CA9MAOA

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 2115/4885PTPRC 4495/4885PTPN1 3475/4885

“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.