SCHEMBL20174386

SCHEMBL20174386

c1ccc(-c2cccc(-c3cc(-c4ccccc4)nc(-c4ccccc4-c4ccc5c(c4)C4(c6ccccc6-5)c5ccccc5-c5c4oc4ccccc54)n3)c2)cc1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 3/20 0.33
PLA2G2A P14555 2/20 0.32
PLA2G4A P47712 2/20 0.32
ENPP3 O14638 1/20 0.32
KDM4E B2RXH2 2/20 0.31
MEN1 O00255 2/20 0.31
ALDH1A1 P00352 2/20 0.31
LMNA P02545 2/20 0.31
MAPT P10636 2/20 0.31
HPGD P15428 2/20 0.31
KMT2A Q03164 2/20 0.31
GLA P06280 1/20 0.31
PLA2G10 O15496 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
SCHEMBL20174407 0.94 KMT2A (0.37) PDK2PLA2G2APLA2G4AKDM4EMEN1
SCHEMBL20174377 0.94 KMT2A (0.37) PDK2PLA2G2APLA2G4AKDM4EMEN1
SCHEMBL20174321 0.93 KMT2A (0.38) PDK2PLA2G2APLA2G4AKDM4EMEN1
SCHEMBL20174397 0.92 PDK2 (0.33) PDK2PLA2G2APLA2G4APLA2G10
SCHEMBL20174388 0.92 PDK2 (0.33) PDK2PLA2G2APLA2G4APLA2G10
SCHEMBL20174323 0.91 MAPK1 (0.33) ENPP3KDM4EMEN1ALDH1A1MAPT
SCHEMBL20174723 0.91 ALDH1A1 (0.34) PDK2PLA2G2APLA2G4AENPP3KDM4E
SCHEMBL19008461 0.91 KMT2A (0.37) PDK2PLA2G2APLA2G4AKDM4EMEN1
SCHEMBL20174342 0.91 KMT2A (0.37) PDK2PLA2G2APLA2G4AKDM4EMEN1
SCHEMBL20174393 0.91 KMT2A (0.37) PDK2PLA2G2APLA2G4AKDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10738034-B2 Spiro compound and organic light-emitting device comprising same LG CHEM, LTD. (KR) 2020-08-11 US disclosed
US-20180141933-A1 SPIRO COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2018-05-24 US disclosed
US-20180141933-A1 SPIRO COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2018-05-24 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-10738034-B2 Spiro compound and organic light-emitting device comprising same CRY1, NR2E3, ERG PDK2 651/4885PLA2G2A 4788/4885PLA2G4A 4802/4885
US-20180141933-A1 SPIRO COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME CRY1, NR2E3, ERG PDK2 651/4885PLA2G2A 4788/4885PLA2G4A 4802/4885

“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.