SCHEMBL22181728

SCHEMBL22181728

c1ccc2c(c1)Oc1cccc3c1B2c1cc(-c2ccccc2-c2c4ccccc4cc4c2ccc2ccccc24)ccc1O3

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SOS1 Q07889 1/20 0.40
GPR84 Q9NQS5 3/20 0.32
ALDH1A1 P00352 1/20 0.31
HIF1A Q16665 1/20 0.31
CYP1B1 Q16678 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL22181727 0.94 SOS1 (0.40) SOS1GPR84ALDH1A1HIF1ACYP1B1
SCHEMBL23406363 0.91 SOS1 (0.36) SOS1GPR84ALDH1A1HIF1ACYP1B1
SCHEMBL22181662 0.90 ALDH1A1 (0.32) GPR84ALDH1A1HIF1AHSD17B10
SCHEMBL22181274 0.90 MCL1 (0.32) GPR84ALDH1A1HSD17B10
SCHEMBL22181673 0.89 SOS1 (0.43) SOS1GPR84ALDH1A1HIF1ACYP1B1
SCHEMBL22181515 0.87 GPR84 (0.36) GPR84
SCHEMBL22181543 0.87 KDM4E (0.32)
SCHEMBL22181731 0.86 SOS1 (0.41) SOS1GPR84ALDH1A1HIF1ACYP1B1
SCHEMBL23432479 0.86 SOS1 (0.43) SOS1GPR84ALDH1A1HIF1ACYP1B1
SCHEMBL22181533 0.85 MAOA (0.32) GPR84ALDH1A1HIF1ACYP1B1HSD17B10

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.