SCHEMBL22945197

SCHEMBL22945197

c1ccc2c(c1)-c1cccc3cccc(c13)N2c1nc(-c2ccc3oc4ccccc4c3c2)c2oc3ccccc3c2n1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.34
HSP90AA1 P07900 1/20 0.33
HSP90AB1 P08238 1/20 0.33
PRKDC P78527 1/20 0.32
PDE6D O43924 1/20 0.32
PIM1 P11309 2/20 0.32
CSNK2A2 P19784 2/20 0.32
CSNK2B P67870 2/20 0.32
PIM3 Q86V86 2/20 0.32
PIM2 Q9P1W9 2/20 0.32
ALDH1A1 P00352 5/20 0.31
HPGD P15428 3/20 0.31
TSHR P16473 1/20 0.31
NPC1 O15118 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
RAB9A P51151 1/20 0.31
LMNA P02545 2/20 0.31
MEN1 O00255 2/20 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
SCHEMBL22945198 0.94 PRKDC (0.38) ALOX5PRKDCPDE6DPIM1CSNK2A2
SCHEMBL22944892 0.93 ALOX5 (0.32) ALOX5HSP90AA1HSP90AB1PRKDCPDE6D
SCHEMBL22945933 0.91 NPC1 (0.36) ALOX5PRKDCPDE6DPIM1CSNK2A2
SCHEMBL22945322 0.91 ALOX5 (0.32) ALOX5HSP90AA1HSP90AB1PRKDCNPC1
SCHEMBL22946030 0.90 ALOX5 (0.31) ALOX5HSP90AA1HSP90AB1PRKDCNPC1
SCHEMBL22945935 0.89 PDE6D (0.40) PDE6DPIM1CSNK2A2CSNK2BPIM3
SCHEMBL22945934 0.89 TSHR (0.38) PDE6DPIM1CSNK2A2CSNK2BPIM3
SCHEMBL22945693 0.88 PRKDC (0.36) ALOX5PRKDCPDE6DTSHRNPC1
SCHEMBL22944728 0.87 NPC1 (0.35) ALOX5PRKDCPDE6DPIM1CSNK2A2
SCHEMBL22945210 0.87 PRKDC (0.35) ALOX5PRKDCPIM1CSNK2A2CSNK2B

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 ALOX5 386/4885HSP90AA1 4463/4885HSP90AB1 4335/4885
US-11812658-B2 Compound and organic light emitting diode comprising same DRD1, DRD3, DRD2 ALOX5 386/4885HSP90AA1 4463/4885HSP90AB1 4335/4885

“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.