SCHEMBL22944948

SCHEMBL22944948

c1ccc2c(c1)-c1cccc3cccc(c13)N2c1ccc2ccc(-c3nc(-c4ccc5oc6ccccc6c5c4)c4oc5ccccc5c4n3)cc2c1

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE6D O43924 1/20 0.32
ALDH1A1 P00352 4/20 0.32
TSHR P16473 3/20 0.32
HPGD P15428 2/20 0.32
NPC1 O15118 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
RAB9A P51151 1/20 0.32
MAPT P10636 4/20 0.32
LMNA P02545 3/20 0.32
KDM4E B2RXH2 3/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
POLB P06746 2/20 0.32
GAA P10253 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
ALOX5 P09917 1/20 0.30
MAPK1 P28482 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL22945701 0.94 NPC1 (0.32) PDE6DALDH1A1TSHRHPGDNPC1
SCHEMBL22945992 0.92 PDE6D (0.31) PDE6DALDH1A1TSHRHPGDNPC1
SCHEMBL22945588 0.92 PDE6D (0.31) PDE6DALDH1A1TSHRHPGDNPC1
SCHEMBL22945594 0.88 MAPK9 (0.33) PDE6DALDH1A1TSHRHPGDNPC1
SCHEMBL22944979 0.88 PDE6D (0.36) PDE6DALDH1A1TSHRHPGDCYP1A2
SCHEMBL22945197 0.85 ALOX5 (0.34) PDE6DALDH1A1TSHRHPGDNPC1
SCHEMBL22945430 0.84 PDE6D (0.30) PDE6D
SCHEMBL22945185 0.83 MAPK9 (0.32) PDE6DALDH1A1TSHRHPGDNPC1
SCHEMBL22945710 0.82 PRKDC (0.35) PDE6DALDH1A1TSHRHPGDCYP1A2
SCHEMBL22945933 0.82 NPC1 (0.36) PDE6DALDH1A1TSHRNPC1CYP1A2

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 342/4885ALDH1A1 271/4885TSHR 716/4885
US-11812658-B2 Compound and organic light emitting diode comprising same DRD1, DRD3, DRD2 PDE6D 342/4885ALDH1A1 271/4885TSHR 716/4885

“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.