SCHEMBL21564037

SCHEMBL21564037

Cn1c2ccccc2c(=O)c2c3[nH]c4ccccc4c(=O)c3c3[nH]c4ccccc4c(=O)c3c21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK4 P11802 3/20 0.56
▸ CCND1 P24385 3/20 0.56
▸ ROCK2 O75116 1/20 0.51
▸ AHR P35869 1/20 0.47
▸ GABRP O00591 2/20 0.47
▸ GABRD O14764 2/20 0.47
▸ GABRA1 P14867 2/20 0.47
▸ GABRB1 P18505 2/20 0.47
▸ GABRG2 P18507 2/20 0.47
▸ GABRB3 P28472 2/20 0.47
▸ GABRA5 P31644 2/20 0.47
▸ GABRA3 P34903 2/20 0.47
▸ GABRA2 P47869 2/20 0.47
▸ GABRB2 P47870 2/20 0.47
▸ GABRA4 P48169 2/20 0.47
▸ GABRE P78334 2/20 0.47
▸ GABRA6 Q16445 2/20 0.47
▸ GABRG1 Q8N1C3 2/20 0.47
▸ GABRG3 Q99928 2/20 0.47
▸ GABRQ Q9UN88 2/20 0.47

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
SCHEMBL21564038 0.97 CDK4 (0.56) CDK4CCND1ROCK2AHRGABRP
SCHEMBL9394723 0.83 CDK4 (0.57) CDK4CCND1ROCK2AHRGABRP
SCHEMBL13772111 0.82 CDK4 (0.57) CDK4CCND1ROCK2AHRGABRP
SCHEMBL31666393 0.81 CDK4 (0.62) CDK4CCND1ROCK2AHRGABRP
SCHEMBL31666388 0.81 CDK4 (0.62) CDK4CCND1ROCK2AHRGABRP
SCHEMBL21564036 0.81 HTT (0.61) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL21563828 0.80 KDM4E (0.67) CDK4CCND1HTTMAPTKDM4E
SCHEMBL21563957 0.78 CDK4 (0.51) CDK4CCND1HTTKDM4EALDH1A1
SCHEMBL17029497 0.76 CDK4 (0.55) CDK4CCND1ROCK2AHRGABRP
SCHEMBL11736118 0.74 CDK4 (0.60) CDK4CCND1ROCK2AHRGABRP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11322693-B2 Organic light-emitting element, and light-emitting material and fluorescent body used in same KYUSHU UNIVERSITY NATIONAL UNIVERSITY CORPORATION (JP) 2022-05-03 — — US disclosed
US-20190348617-A1 ORGANIC LIGHT-EMITTING ELEMENT, AND LIGHT-EMITTING MATERIAL AND FLUORESCENT BODY USED IN SAME KYUSHU UNIVERSITY NATIONAL UNIVERSITY CORPORATION (JP) 2019-11-14 — — US disclosed
Send feedback