SCHEMBL18522516

SCHEMBL18522516

N#Cc1ccc(-n2c3ccccc3c3cc(N(c4ccc(-c5ccc(-c6ccccc6)cc5)cc4)c4ccc5c(c4)c4ccccc4n5-c4ccc(C#N)cc4)ccc32)cc1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 8/20 0.43
▸ KDM4E B2RXH2 1/20 0.41
▸ ATM Q13315 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ USP14 P54578 2/20 0.38
▸ PTGER4 P35408 2/20 0.37
▸ ABCG2 Q9UNQ0 1/20 0.36
▸ GABRA1 P14867 1/20 0.36
▸ GABRG2 P18507 1/20 0.36
▸ GABRB3 P28472 1/20 0.36
▸ GABRA5 P31644 1/20 0.36
▸ GABRA3 P34903 1/20 0.36
▸ TSPO P30536 1/20 0.36
▸ HDAC4 P56524 1/20 0.36
▸ PER2 O15055 1/20 0.35
▸ CRY1 Q16526 1/20 0.35
▸ CRY2 Q49AN0 1/20 0.35

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
SCHEMBL18522517 1.00 RORC (0.43) RORCKDM4EATML3MBTL1USP14
SCHEMBL18522520 1.00 RORC (0.43) RORCKDM4EATML3MBTL1USP14
SCHEMBL18388683 0.98 RORC (0.43) RORCKDM4EATML3MBTL1USP14
SCHEMBL8951955 0.96 KDM4E (0.45) RORCKDM4EATML3MBTL1USP14
SCHEMBL8947781 0.96 KDM4E (0.45) RORCKDM4EATML3MBTL1USP14
SCHEMBL13750004 0.96 KDM4E (0.45) RORCKDM4EATML3MBTL1USP14
SCHEMBL18511468 0.94 RORC (0.45) RORCKDM4EATML3MBTL1USP14
SCHEMBL20812722 0.94 ATM (0.46) RORCKDM4EATML3MBTL1USP14
SCHEMBL21364997 0.94 ATM (0.46) RORCKDM4EATML3MBTL1USP14
SCHEMBL20812933 0.94 ATM (0.46) RORCKDM4EATML3MBTL1USP14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10043981-B2 Light-emitting material, organic light-emitting device, and compound KYULUX, INC. (JP) 2018-08-07 — — US disclosed
US-20170338418-A1 LIGHT-EMITTING MATERIAL, ORGANIC LIGHT-EMITTING DEVICE, AND COMPOUND KYULUX, INC. (JP) 2017-11-23 — — US disclosed
US-9773982-B2 Light-emitting material, organic light-emitting device, and compound KYULUX, INC. (JP) 2017-09-26 — — US disclosed
US-20170047522-A1 LIGHT-EMITTING MATERIAL, ORGANIC LIGHT-EMITTING DEVICE, AND COMPOUND KYULUX, INC. (JP) 2017-02-16 — — 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 (3 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-10043981-B2 Light-emitting material, organic light-emitting device, and compound GRK1, ARL1, NR2E3 RORC 990/4885KDM4E 3726/4885ATM 1646/4885
US-20170047522-A1 LIGHT-EMITTING MATERIAL, ORGANIC LIGHT-EMITTING DEVICE, AND COMPOUND GRK1, ARL1, NR2E3 RORC 990/4885KDM4E 3726/4885ATM 1646/4885
US-20170338418-A1 LIGHT-EMITTING MATERIAL, ORGANIC LIGHT-EMITTING DEVICE, AND COMPOUND GRK1, ARL1, NR2E3 RORC 990/4885KDM4E 3726/4885ATM 1646/4885

“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.

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