SCHEMBL22944744

SCHEMBL22944744

c1ccc(-c2ccc(-c3nc(N4c5ccc6ccccc6c5-c5cccc6cccc4c56)nc4c3oc3ccccc34)cc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE6D O43924 1/20 0.37
TSHR P16473 4/20 0.34
ADORA2A P29274 1/20 0.34
MAPT P10636 9/20 0.33
ALDH1A1 P00352 4/20 0.32
LMNA P02545 4/20 0.32
KDM4E B2RXH2 3/20 0.32
HSD17B10 Q99714 2/20 0.32
POLB P06746 2/20 0.32
MAPK1 P28482 1/20 0.32
HPGD P15428 1/20 0.32
KMT2A Q03164 4/20 0.32
MEN1 O00255 3/20 0.32
NPSR1 Q6W5P4 1/20 0.32
CSF1R P07333 1/20 0.32
PDGFRB P09619 1/20 0.32
KIT P10721 1/20 0.32
FLT3 P36888 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
USP2 O75604 1/20 0.32

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
SCHEMBL22945991 0.98 TSHR (0.35) PDE6DTSHRADORA2AMAPTALDH1A1
SCHEMBL22946033 0.94 NPC1 (0.33) PDE6DHSD17B10CYP1A2CYP2C9CYP2C19
SCHEMBL22944743 0.92 NPC1 (0.34) PDE6DTSHRMAPTALDH1A1HSD17B10
SCHEMBL22944778 0.92 KDM4E (0.34) TSHRMAPTALDH1A1LMNAKDM4E
SCHEMBL22944745 0.92 ADORA2A (0.33) PDE6DTSHRADORA2AMAPTALDH1A1
SCHEMBL22946036 0.90 HSD17B10 (0.32) TSHRMAPTALDH1A1LMNAKDM4E
SCHEMBL22946028 0.90 PRKDC (0.35) HSD17B10
SCHEMBL22946030 0.90 ALOX5 (0.31) HSD17B10CYP1A2CYP2C9CYP2C19
SCHEMBL22945935 0.89 PDE6D (0.40) PDE6DTSHRADORA2AMAPTALDH1A1
SCHEMBL22946029 0.89 PRKDC (0.33) TSHRALDH1A1KDM4EHSD17B10KMT2A

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 PDE6D 342/4885TSHR 716/4885ADORA2A 1641/4885
US-11812658-B2 Compound and organic light emitting diode comprising same DRD1, DRD3, DRD2 PDE6D 342/4885TSHR 716/4885ADORA2A 1641/4885

“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.