SCHEMBL19767413

SCHEMBL19767413

c1ccc(-c2nc(-c3cc(-c4ccc5oc6ccccc6c5c4)cc(-c4ccc5oc6ccccc6c5c4)c3)cc(-c3cccc(-c4ccc5ccc6cccnc6c5n4)c3)n2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATR Q13535 1/20 0.36
PLA2G10 O15496 1/20 0.35
PLA2G2A P14555 1/20 0.35
PLA2G4A P47712 1/20 0.35
MAPT P10636 4/20 0.35
NPC1 O15118 1/20 0.35
ECE1 P42892 1/20 0.35
TOP1 P11387 6/20 0.34
PIM1 P11309 1/20 0.34
PIM3 Q86V86 1/20 0.34
PIM2 Q9P1W9 1/20 0.34
KDM4E B2RXH2 4/20 0.34
HPGD P15428 4/20 0.34
KMT2A Q03164 3/20 0.34
ALDH1A1 P00352 3/20 0.34
MEN1 O00255 2/20 0.34
LMNA P02545 2/20 0.34
GLA P06280 1/20 0.34
CASP3 P42574 1/20 0.34
SENP7 Q9BQF6 1/20 0.34

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
SCHEMBL19767408 1.00 ATR (0.36) ATRPLA2G10PLA2G2APLA2G4AMAPT
SCHEMBL19767410 0.99 ATR (0.36) ATRPLA2G10PLA2G2APLA2G4AMAPT
SCHEMBL19767407 0.98 TOP1 (0.37) ATRPLA2G10PLA2G2APLA2G4AMAPT
SCHEMBL19165929 0.97 TOP1 (0.38) ATRPLA2G10PLA2G2APLA2G4AMAPT
SCHEMBL15581929 0.97 TOP1 (0.38) ATRPLA2G10PLA2G2APLA2G4AMAPT
SCHEMBL19767409 0.96 ATR (0.36) ATRPLA2G10PLA2G2APLA2G4AMAPT
SCHEMBL15581924 0.96 TOP1 (0.37) ATRPLA2G10PLA2G2APLA2G4AMAPT
SCHEMBL19486655 0.96 TOP1 (0.37) ATRPLA2G10PLA2G2APLA2G4AMAPT
SCHEMBL19767412 0.96 TOP1 (0.37) ATRPLA2G10PLA2G2APLA2G4AMAPT
SCHEMBL19767416 0.95 MAPT (0.36) ATRPLA2G10PLA2G2APLA2G4AMAPT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180102484-A1 NEW COMPOUND, ORGANIC ELECTROLUMINESCENCE DEVICE MATERIAL, ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2018-04-12 US disclosed
US-20180102484-A1 NEW COMPOUND, ORGANIC ELECTROLUMINESCENCE DEVICE MATERIAL, ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2018-04-12 US disclosed
US-9871206-B2 Compound, organic electroluminescence device material, organic electroluminescence device and electronic device IDEMITSU KOSAN CO., LTD. (JP) 2018-01-16 US disclosed
US-9871206-B2 Compound, organic electroluminescence device material, organic electroluminescence device and electronic device IDEMITSU KOSAN CO., LTD. (JP) 2018-01-16 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 (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-20180102484-A1 NEW COMPOUND, ORGANIC ELECTROLUMINESCENCE DEVICE MATERIAL, ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC DEVICE CBX8, MLX, HAX1 ATR 1824/4885PLA2G10 4319/4885PLA2G2A 4473/4885

“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.