SCHEMBL22329461

SCHEMBL22329461

c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4c(c3)oc3ccc(-c5nc(-c6ccccc6)nc6c5sc5ccccc56)cc34)n2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 3/20 0.35
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
ATM Q13315 1/20 0.34
ALDH1A1 P00352 4/20 0.34
HPGD P15428 2/20 0.34
TNKS O95271 2/20 0.33
TNKS2 Q9H2K2 2/20 0.33
PRKDC P78527 1/20 0.33
MMP12 P39900 1/20 0.33
MAPT P10636 4/20 0.32
ESR2 Q92731 1/20 0.32
CDK5 Q00535 1/20 0.32
CDK5R1 Q15078 1/20 0.32
POLB P06746 3/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
PIM1 P11309 1/20 0.32
PIM3 Q86V86 1/20 0.32
PIM2 Q9P1W9 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
SCHEMBL22195761 1.00 LIMK1 (0.35) LIMK1MEN1KMT2AATMALDH1A1
SCHEMBL22330218 0.99 LIMK1 (0.37) LIMK1MEN1KMT2AATMALDH1A1
SCHEMBL25019847 0.99 LIMK1 (0.37) LIMK1MEN1KMT2AATMALDH1A1
SCHEMBL22195814 0.98 MEN1 (0.36) LIMK1MEN1KMT2AATMALDH1A1
SCHEMBL22330236 0.98 MEN1 (0.36) LIMK1MEN1KMT2AATMALDH1A1
SCHEMBL22195663 0.97 LIMK1 (0.35) LIMK1MEN1KMT2AATMALDH1A1
SCHEMBL22329900 0.97 LIMK1 (0.37) LIMK1MEN1KMT2AATMALDH1A1
SCHEMBL22330199 0.97 LIMK1 (0.37) LIMK1MEN1KMT2AATMALDH1A1
SCHEMBL22195576 0.97 LIMK1 (0.37) LIMK1MEN1KMT2AATMALDH1A1
SCHEMBL22196014 0.97 KMT2A (0.36) LIMK1MEN1KMT2AATMALDH1A1

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-11581494-B2 Organic light emitting device LG CHEM, LTD. (KR) 2023-02-14 US disclosed
US-20200259098-A1 ORGANIC LIGHT EMITTING DEVICE LG CHEM, LTD. (KR) 2020-08-13 US disclosed