SCHEMBL24037086

SCHEMBL24037086

c1ccc(-c2ccc3c(c2)c2ccccc2c2[nH]c4c5ccccc5c5ccccc5c4c32)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TNKS2 Q9H2K2 1/20 0.41
▸ CDK4 P11802 3/20 0.40
▸ CCND1 P24385 3/20 0.40
▸ JAK2 O60674 2/20 0.40
▸ PRMT5 O14744 1/20 0.40
▸ GABRP O00591 1/20 0.39
▸ GABRD O14764 1/20 0.39
▸ GABRA1 P14867 1/20 0.39
▸ GABRB1 P18505 1/20 0.39
▸ GABRG2 P18507 1/20 0.39
▸ GABRB3 P28472 1/20 0.39
▸ GABRA5 P31644 1/20 0.39
▸ GABRA3 P34903 1/20 0.39
▸ GABRA2 P47869 1/20 0.39
▸ GABRB2 P47870 1/20 0.39
▸ GABRA4 P48169 1/20 0.39
▸ GABRE P78334 1/20 0.39
▸ GABRA6 Q16445 1/20 0.39
▸ GABRG1 Q8N1C3 1/20 0.39
▸ GABRG3 Q99928 1/20 0.39

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
SCHEMBL24037092 0.96 TNKS2 (0.41) TNKS2CDK4CCND1JAK2PRMT5
SCHEMBL20243934 0.84 MAOA (0.43) TNKS2JAK2ALOX5KDM4EMEN1
SCHEMBL1614546 0.83 ALDH1A1 (0.50) TNKS2JAK2MKNK1ALOX5NPC1
SCHEMBL14479463 0.83 ALDH1A1 (0.50) TNKS2JAK2MKNK1ALOX5NPC1
SCHEMBL21709360 0.82 KIF11 (0.47) TNKS2CDK4CCND1KDM4EMEN1
SCHEMBL27404197 0.81 CDK4 (0.48) TNKS2CDK4CCND1JAK2GABRP
SCHEMBL30936673 0.81 CDK4 (0.48) TNKS2CDK4CCND1JAK2GABRP
SCHEMBL1615585 0.81 ALDH1A1 (0.53) TNKS2JAK2MKNK1ALOX5NPC1
SCHEMBL762494 0.81 GABRP (0.46) TNKS2CDK4CCND1GABRPGABRD
SCHEMBL14958604 0.79 MEN1 (0.48) JAK2ALOX5MEN1KMT2ADHFR

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-2021230651-A1 ORGANIC ELECTRONIC ELEMENT COMPRISING COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2021-11-18 — — WO disclosed
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