SCHEMBL22945594

SCHEMBL22945594

c1ccc2c(c1)-c1cccc3cccc(c13)N2c1ccc2cc(-c3nc(-c4ccncc4)c4oc5ccccc5c4n3)ccc2c1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK9 P45984 4/20 0.33
MAPK10 P53779 4/20 0.33
PDE6D O43924 1/20 0.32
TSHR P16473 5/20 0.32
ALDH1A1 P00352 7/20 0.32
KDM4E B2RXH2 6/20 0.32
LMNA P02545 5/20 0.32
HSD17B10 Q99714 5/20 0.32
KMT2A Q03164 4/20 0.32
HPGD P15428 3/20 0.32
CYP1A2 P05177 2/20 0.32
CYP2C9 P11712 2/20 0.32
CYP2C19 P33261 2/20 0.32
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
POLB P06746 2/20 0.32
MAPK8 P45983 2/20 0.32
MEN1 O00255 3/20 0.32
MAPT P10636 6/20 0.31
MAPK1 P28482 3/20 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
SCHEMBL22945185 0.95 MAPK9 (0.32) MAPK9MAPK10PDE6DTSHRALDH1A1
SCHEMBL22945040 0.92 MAPK9 (0.32) MAPK9MAPK10PDE6DTSHRALDH1A1
SCHEMBL22945731 0.92 MAPK9 (0.32) MAPK9MAPK10PDE6DTSHRALDH1A1
SCHEMBL22944948 0.88 PDE6D (0.32) PDE6DTSHRALDH1A1KDM4ELMNA
SCHEMBL22945701 0.84 NPC1 (0.32) PDE6DTSHRALDH1A1KDM4ELMNA
SCHEMBL22944979 0.84 PDE6D (0.36) PDE6DTSHRALDH1A1KDM4ELMNA
SCHEMBL21515473 0.84 PDE6D (0.38) MAPK9MAPK10PDE6DTSHRALDH1A1
SCHEMBL22944720 0.82 ALDH1A1 (0.36) PDE6DTSHRALDH1A1KDM4ELMNA
SCHEMBL22945593 0.82 MAPT (0.43) PDE6DTSHRALDH1A1KDM4ELMNA
SCHEMBL22945956 0.81 MEN1 (0.30) TSHRALDH1A1HSD17B10KMT2AMEN1

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-11812658-B2 Compound and organic light emitting diode comprising same LG CHEM, LTD. (KR) 2023-11-07 US disclosed
US-11812658-B2 Compound and organic light emitting diode comprising same LG CHEM, LTD. (KR) 2023-11-07 US disclosed
US-20210036236-A1 COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME LG CHEM, LTD. (KR) 2021-02-04 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-20210036236-A1 COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME DRD1, DRD3, DRD2 MAPK9 2688/4885MAPK10 2962/4885PDE6D 342/4885
US-11812658-B2 Compound and organic light emitting diode comprising same DRD1, DRD3, DRD2 MAPK9 2688/4885MAPK10 2962/4885PDE6D 342/4885

“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.