SCHEMBL21476563

SCHEMBL21476563

c1ccc(-c2ccccc2-c2cc(-c3ccc(-c4cc5ccccc5o4)cc3)nc(-c3ccc4c(c3)oc3ccccc34)n2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 6/20 0.43
PTPRC P08575 1/20 0.41
PTPN1 P18031 1/20 0.41
RAB9A P51151 4/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
CA9 Q16790 2/20 0.40
TNKS O95271 2/20 0.40
NPC1 O15118 2/20 0.40
CYP19A1 P11511 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
GABRP O00591 1/20 0.40
GABRD O14764 1/20 0.40
CA12 O43570 1/20 0.40
TP53 P04637 1/20 0.40
ABCB1 P08183 1/20 0.40
CYP3A4 P08684 1/20 0.40
PARP1 P09874 1/20 0.40
ADORA3 P0DMS8 1/20 0.40
AR P10275 1/20 0.40

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
SCHEMBL21476381 0.93 CYP19A1 (0.41) MAOBPTPRCPTPN1RAB9ACA1
SCHEMBL21480652 0.92 MAOB (0.48) MAOBRAB9ACA1CA2CA9
SCHEMBL21476837 0.90 MAOB (0.44) MAOBPTPRCPTPN1RAB9ACA1
SCHEMBL21476571 0.89 MAOB (0.41) MAOBPTPRCPTPN1RAB9ACA1
SCHEMBL21476620 0.88 MAOB (0.45) MAOBPTPRCPTPN1RAB9ACA1
SCHEMBL21476569 0.88 ALOX5 (0.43) MAOBPTPRCPTPN1RAB9ACA1
SCHEMBL21476552 0.87 PLA2G2A (0.48) MAOBRAB9ACA1CA2CA9
SCHEMBL23335209 0.87 CYP19A1 (0.43) MAOBRAB9ACA1CA2CA9
SCHEMBL21476556 0.87 MAOB (0.50) MAOBPTPRCPTPN1RAB9ACA1
SCHEMBL15501392 0.87 MEN1 (0.45) MAOBSMN1; SMN2HPGDMAOAALOX5

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.