SCHEMBL23487302

SCHEMBL23487302

Cc1cc(C)cc(-c2ccc3c4ccc(-c5cc(C)cc(C)c5)cc4n(-c4cc(-c5nc(C)cc(C)n5)cc(-n5c6cc(-c7cc(C)cc(C)c7)ccc6c6ccc(-c7cc(C)cc(C)c7)cc65)c4C#N)c3c2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM5B Q9UGL1 2/20 0.40
KDM4A O75164 1/20 0.34
ALDH1A1 P00352 4/20 0.32
HPGD P15428 4/20 0.32
KDM4E B2RXH2 3/20 0.32
NPSR1 Q6W5P4 2/20 0.32
PPARG P37231 1/20 0.32
STAT3 P40763 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
NR2E3 Q9Y5X4 1/20 0.32
NCOR2 Q9Y618 1/20 0.32
AURKA O14965 1/20 0.31
KDR P35968 1/20 0.31
AURKB Q96GD4 1/20 0.31
HTT P42858 1/20 0.31
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31
METAP2 P50579 1/20 0.31
IRAK4 Q9NWZ3 1/20 0.31
MEN1 O00255 1/20 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
SCHEMBL23487672 0.94 KDM5B (0.37) KDM5BKDM4AALDH1A1HPGDKDM4E
SCHEMBL23487305 0.92 NPSR1 (0.37) KDM5BALDH1A1HPGDKDM4ENPSR1
SCHEMBL19913310 0.91 KDM5B (0.42) KDM5BKDM4AALDH1A1HPGDKDM4E
SCHEMBL22563586 0.91 KDM4A (0.41) KDM5BKDM4AALDH1A1HPGDKDM4E
SCHEMBL21109725 0.91 KDM5B (0.40) KDM5BKDM4AALDH1A1HPGDNPSR1
SCHEMBL22563675 0.89 ABCG2 (0.34) IRAK4ABCG2
SCHEMBL22563487 0.88 KDM4E (0.31) KDM5BALDH1A1HPGDKDM4ENPSR1
SCHEMBL22563573 0.88 KDM4E (0.40) KDM5BKDM4AALDH1A1HPGDKDM4E
SCHEMBL22563378 0.88 CHEK1 (0.40) ALDH1A1IRAK4MEN1KMT2AABCG2
SCHEMBL22563686 0.88 NPSR1 (0.34) ALDH1A1HPGDKDM4ENPSR1PPARG

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210175434-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2021-06-10 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 (1 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-20210175434-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, OR51E2, OCIAD2 KDM5B 4508/4885KDM4A 4506/4885ALDH1A1 80/4885

“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.