SCHEMBL23028866

SCHEMBL23028866

Cc1nc(-c2cccc3ccccc23)c2sc3ccccc3c2n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TNKS O95271 2/20 0.40
▸ TNKS2 Q9H2K2 2/20 0.40
▸ MAPT P10636 3/20 0.39
▸ PIM1 P11309 1/20 0.38
▸ PIM2 Q9P1W9 1/20 0.38
▸ ALDH1A1 P00352 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ LIMK1 P53667 2/20 0.37
▸ HRH4 Q9H3N8 1/20 0.37
▸ CDK5 Q00535 1/20 0.37
▸ CDK5R1 Q15078 1/20 0.37
▸ CYP2A6 P11509 1/20 0.37
▸ ATM Q13315 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ HTR2C P28335 1/20 0.36
▸ DHFR P00374 1/20 0.35
▸ KRAS P01116 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
SCHEMBL20226314 0.84 TNKS (0.42) TNKSTNKS2MAPTPIM1PIM2
SCHEMBL17297448 0.83 LIMK1 (0.37) TNKSTNKS2MAPTPIM1PIM2
SCHEMBL23185178 0.82 TNKS (0.41) TNKSTNKS2MAPTPIM1PIM2
SCHEMBL19169895 0.81 TNKS (0.46) TNKSTNKS2MAPTPIM1PIM2
SCHEMBL16902209 0.81 ALDH1A1 (0.43) TNKSTNKS2MAPTALDH1A1KDM4E
SCHEMBL19169897 0.78 TNKS (0.47) TNKSTNKS2MAPTPIM1PIM2
SCHEMBL19169558 0.78 TNKS (0.44) TNKSTNKS2MAPTPIM1PIM2
SCHEMBL19986176 0.78 TNKS (0.41) TNKSTNKS2MAPTPIM1PIM2
SCHEMBL24104504 0.78 TUBB4A (0.34) TNKSTNKS2MAPTPIM1PIM2
SCHEMBL16919853 0.77 MAPT (0.54) TNKSTNKS2MAPTPIM1PIM2

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
WO-2021135181-A1 NITROGEN-CONTAINING COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE AND ELECTRONIC DEVICE 陕西莱特光电材料股份有限公司 2021-07-08 — — WO disclosed
WO-2021034089-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2021-02-25 — — WO disclosed
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