SCHEMBL25874443

SCHEMBL25874443

Nc1ccccc1-c1ccccc1-c1nc(-c2ccccc2)nc(-c2ccccc2-c2ccccc2-c2nc3ccccc3s2)n1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 11/20 0.67
▸ NPC1 O15118 8/20 0.67
▸ KDM4E B2RXH2 7/20 0.67
▸ MAPT P10636 6/20 0.67
▸ SMN1; SMN2 Q16637 6/20 0.67
▸ MEN1 O00255 5/20 0.67
▸ KMT2A Q03164 5/20 0.67
▸ ALDH1A1 P00352 4/20 0.67
▸ GAA P10253 4/20 0.67
▸ L3MBTL1 Q9Y468 4/20 0.67
▸ TDP1 Q9NUW8 3/20 0.67
▸ APP P05067 5/20 0.51
▸ MMP9 P14780 1/20 0.51
▸ MMP8 P22894 1/20 0.51
▸ NFKB1 P19838 2/20 0.48
▸ NFKB2 Q00653 2/20 0.48
▸ RELA Q04206 2/20 0.48
▸ ILK Q13418 2/20 0.46
▸ HSD17B10 Q99714 3/20 0.45
▸ POLB P06746 2/20 0.45

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
SCHEMBL25874357 0.89 RAB9A (0.56) RAB9ANPC1KDM4EMAPTSMN1; SMN2
SCHEMBL25875040 0.89 RAB9A (0.56) RAB9ANPC1KDM4EMAPTSMN1; SMN2
SCHEMBL25875198 0.88 APP (0.61) RAB9ANPC1KDM4EMAPTSMN1; SMN2
SCHEMBL914476 0.81 KDM4E (1.00) RAB9ANPC1KDM4EMAPTSMN1; SMN2
SCHEMBL29437945 0.81 KDM4E (1.00) RAB9ANPC1KDM4EMAPTSMN1; SMN2
SCHEMBL25875174 0.79 THRB (0.44) RAB9ANPC1KDM4EMAPTSMN1; SMN2
SCHEMBL22178377 0.78 RAB9A (0.50) RAB9ANPC1KDM4EMAPTSMN1; SMN2
SCHEMBL4412613 0.78 RAB9A (0.64) RAB9ANPC1KDM4EMAPTSMN1; SMN2
SCHEMBL12854008 0.78 KDM4E (0.72) RAB9ANPC1KDM4EMAPTSMN1; SMN2
SCHEMBL22177644 0.77 RAB9A (0.49) RAB9ANPC1KDM4EMAPTSMN1; SMN2

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
WO-2023140649-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2023-07-27 — — WO disclosed
Send feedback