SCHEMBL22944969

SCHEMBL22944969

c1ccc2c(c1)-c1cccc3cccc(c13)N2c1nc(-c2cccc3ccccc23)c2sc3ccccc3c2n1

nearest known ligand 0.32

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.32
PIM1 P11309 1/20 0.32
PIM2 Q9P1W9 1/20 0.32
HRH4 Q9H3N8 1/20 0.31
PDE6D O43924 1/20 0.30
ALDH1A1 P00352 2/20 0.30
MAPT P10636 2/20 0.30
TSHR P16473 1/20 0.30
MAPK1 P28482 1/20 0.30
ATM Q13315 1/20 0.30
HSD17B10 Q99714 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
LIMK1 P53667 1/20 0.30
CDK5 Q00535 1/20 0.30
CDK5R1 Q15078 1/20 0.30
HPGD P15428 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL22945232 0.92 ALOX5 (0.34) PIM1PIM2HRH4PDE6DMAPT
SCHEMBL22945764 0.92 ALDH1A1 (0.34) ALDH1A1TSHRMAPK1HSD17B10HPGD
SCHEMBL22944980 0.92 PDE6D (0.35) PDE6DMAPTMAPK1L3MBTL1LIMK1
SCHEMBL22945914 0.91 BRDT (0.31) PIM1PIM2HRH4
SCHEMBL22945611 0.90 POLB (0.30) POLBPIM1PIM2
SCHEMBL22945492 0.90 PDE6D (0.37) PIM1PIM2HRH4PDE6DMAPT
SCHEMBL22945278 0.89
SCHEMBL22944962 0.89 ALDH1A1 (0.36) POLBALDH1A1MAPTTSHRLIMK1
SCHEMBL22945494 0.88 PDE6D (0.40) PIM1PIM2PDE6DMAPTMAPK1
SCHEMBL22944957 0.87 KDM4E (0.33) HRH4PDE6DALDH1A1MAPTMAPK1

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 POLB 3384/4885PIM1 2938/4885PIM2 3320/4885
US-11812658-B2 Compound and organic light emitting diode comprising same DRD1, DRD3, DRD2 POLB 3384/4885PIM1 2938/4885PIM2 3320/4885

“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.