SCHEMBL22181731

SCHEMBL22181731

c1ccc2c(c1)Oc1cccc3c1B2c1cccc(-c2ccccc2-c2c4ccccc4cc4c2ccc2ccccc24)c1O3

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SOS1 Q07889 1/20 0.41
GPR84 Q9NQS5 1/20 0.33
ALDH1A1 P00352 2/20 0.32
HIF1A Q16665 2/20 0.32
HSD17B10 Q99714 2/20 0.32
CYP1B1 Q16678 1/20 0.32
ANPEP P15144 1/20 0.32
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
CASP1 P29466 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL23432479 0.96 SOS1 (0.43) SOS1GPR84ALDH1A1HIF1AHSD17B10
SCHEMBL22181661 0.91 SOS1 (0.41) SOS1GPR84ALDH1A1HIF1AHSD17B10
SCHEMBL22181528 0.90 MAPK1 (0.35) GPR84ALDH1A1HIF1AHSD17B10HPGD
SCHEMBL22181273 0.89 GPR84 (0.32) GPR84MAPK1
SCHEMBL23432632 0.88 ALDH1A1 (0.39) GPR84ALDH1A1HIF1AHSD17B10CYP1B1
SCHEMBL22181728 0.86 SOS1 (0.40) SOS1GPR84ALDH1A1HIF1AHSD17B10
SCHEMBL22181727 0.86 SOS1 (0.40) SOS1GPR84ALDH1A1HIF1AHSD17B10
SCHEMBL22181673 0.85 SOS1 (0.43) SOS1GPR84ALDH1A1HIF1AHSD17B10
SCHEMBL22181531 0.85 MAOA (0.32) GPR84ALDH1A1HIF1AHSD17B10CYP1B1
SCHEMBL23432606 0.85 MAPK1 (0.34) GPR84ALDH1A1HIF1AHSD17B10HPGD

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-11248009-B2 Polycyclic aromatic compound, material for an organic device, organic electroluminescent element, display apparatus and lighting apparatus KWANSEI GAKUIN EDUCATIONAL FOUNDATION (JP) 2022-02-15 US disclosed
US-20200207787-A1 POLYCYCLIC AROMATIC COMPOUND, MATERIAL FOR AN ORGANIC DEVICE, ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY APPARATUS AND LIGHTING APPARATUS KWANSEI GAKUIN EDUCATIONAL FOUNDATION (JP) 2020-07-02 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 (2 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-11248009-B2 Polycyclic aromatic compound, material for an organic device, organic electroluminescent element, display apparatus and lighting apparatus TYR, AOC2, AOC1 SOS1 15/4885GPR84 3172/4885ALDH1A1 791/4885
US-20200207787-A1 POLYCYCLIC AROMATIC COMPOUND, MATERIAL FOR AN ORGANIC DEVICE, ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY APPARATUS AND LIGHTING APPARATUS TYR, AOC2, AOC1 SOS1 15/4885GPR84 3172/4885ALDH1A1 791/4885

“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.