SCHEMBL22944779

SCHEMBL22944779

c1ccc2c3c(ccc2c1)-c1cccc2cccc(c12)N3c1nc(-c2cccc3c2oc2ccccc23)c2oc3ccccc3c2n1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.35
PRKDC P78527 3/20 0.33
PIK3CD O00329 1/20 0.33
PIK3CB P42338 1/20 0.33
TSHR P16473 2/20 0.32
PIM1 P11309 1/20 0.31
CSNK2A2 P19784 1/20 0.31
CSNK2B P67870 1/20 0.31
PIM3 Q86V86 1/20 0.31
PIM2 Q9P1W9 1/20 0.31
CDK2 P24941 1/20 0.31
ALDH1A1 P00352 4/20 0.31
KDM4E B2RXH2 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
DRD4 P21917 1/20 0.31
GLA P06280 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MAPT P10636 2/20 0.30
GAA P10253 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
SCHEMBL22945636 0.94 PIM1 (0.32) TSHRPIM1CSNK2A2CSNK2BPIM3
SCHEMBL22946126 0.92 CREBBP (0.31) TSHRPIM1CSNK2A2CSNK2BPIM3
SCHEMBL22944860 0.91 ALDH1A1 (0.34) TSHRALDH1A1KDM4EDRD4L3MBTL1
SCHEMBL22945637 0.90 MAPT (0.33) TSHRPIM1CSNK2A2CSNK2BPIM3
SCHEMBL21515418 0.90 TSHR (0.36) TSHRPIM1CSNK2A2CSNK2BPIM3
SCHEMBL22945210 0.90 PRKDC (0.35) ALOX5PRKDCPIK3CDPIK3CBTSHR
SCHEMBL22944859 0.89 TGFBR1 (0.34) TSHRALDH1A1KDM4EMEN1KMT2A
SCHEMBL22945344 0.88 PDE6D (0.38) TSHRPIM1CSNK2A2CSNK2BPIM3
SCHEMBL22945598 0.88 ALOX5 (0.35) ALOX5PRKDCPIK3CDPIK3CBCDK2
SCHEMBL22946029 0.87 PRKDC (0.33) ALOX5PRKDCPIK3CDPIK3CBTSHR

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 386/4885PRKDC 4810/4885PIK3CD 4301/4885
US-11812658-B2 Compound and organic light emitting diode comprising same DRD1, DRD3, DRD2 ALOX5 386/4885PRKDC 4810/4885PIK3CD 4301/4885

“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.