SCHEMBL24593285

SCHEMBL24593285

CBc1cc2c([nH]c3ccccc32)c2c1-c1ccccc1C2(C)C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 3/20 0.37
PARP14 Q460N5 8/20 0.35
MAPT P10636 3/20 0.34
NPC1 O15118 1/20 0.34
POLB P06746 1/20 0.34
XBP1 P17861 1/20 0.34
RAB9A P51151 1/20 0.34
PARP1 P09874 1/20 0.34
PGR P06401 1/20 0.34
CHEK1 O14757 1/20 0.34
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
HPGD P15428 1/20 0.33
MAPK1 P28482 1/20 0.33
HSD17B10 Q99714 1/20 0.33
BCHE P06276 1/20 0.33
PIM1 P11309 1/20 0.32
PIM3 Q86V86 1/20 0.32

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
SCHEMBL20175707 0.85 KIF11 (0.39) KIF11PARP14MAPTNPC1POLB
SCHEMBL21941921 0.80 PGR (0.40) KIF11PARP14MAPTNPC1POLB
SCHEMBL24730498 0.77 PGR (0.40) KIF11PARP14MAPTNPC1POLB
SCHEMBL15126748 0.75 CHEK1 (0.43) KIF11MAPTPARP1CHEK1KDM4E
SCHEMBL29506381 0.75 CHEK1 (0.43) KIF11MAPTPARP1CHEK1KDM4E
SCHEMBL21151651 0.75 TDO2 (0.36) KIF11PARP14MAPTKDM4EALDH1A1
SCHEMBL1707718 0.74 KIF11 (0.47) KIF11PARP14MAPTPGRKDM4E
SCHEMBL29819516 0.74 KIF11 (0.47) KIF11PARP14MAPTPGRKDM4E
SCHEMBL20152834 0.73 BCHE (0.39) KIF11PARP14MAPTNPC1POLB
SCHEMBL16310278 0.72 CDK4 (0.49) KIF11MAPTPARP1CHEK1KDM4E

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
EP-3266787-B1 COMPOUND FOR ORGANIC ELECTRIC DEVICE, ORGANIC ELECTRIC DEVICE USING THE SAME, AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO LTD (KR) 2022-07-06 EP disclosed