SCHEMBL25646996

SCHEMBL25646996

CC(C)(C)c1ccc2c(c1)C1(c3ccccc3-c3ccc(N)cc31)c1cc(C(C)(C)C)ccc1-2

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 5/20 0.49
SMN1; SMN2 Q16637 4/20 0.46
MAPT P10636 4/20 0.46
LMNA P02545 3/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
KDM4E B2RXH2 2/20 0.46
OPRK1 P41145 1/20 0.46
ALDH1A1 P00352 6/20 0.44
NPC1 O15118 6/20 0.44
RAB9A P51151 6/20 0.44
PLA2G1B P04054 2/20 0.44
ATG4B Q9Y4P1 2/20 0.44
NFKB1 P19838 1/20 0.44
CASP3 P42574 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
SENP8 Q96LD8 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44

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
SCHEMBL24524489 0.92 ALDH1A1 (0.40) PDK2SMN1; SMN2MAPTLMNAMEN1
SCHEMBL25858113 0.90 ALDH1A1 (0.52) PDK2SMN1; SMN2MAPTLMNAMEN1
SCHEMBL21215242 0.90 ALDH1A1 (0.52) PDK2SMN1; SMN2MAPTLMNAMEN1
SCHEMBL19934339 0.90 ALDH1A1 (0.52) PDK2SMN1; SMN2MAPTLMNAMEN1
SCHEMBL30421958 0.90 ALDH1A1 (0.52) PDK2SMN1; SMN2MAPTLMNAMEN1
SCHEMBL19773711 0.89 ALDH1A1 (0.50) PDK2SMN1; SMN2MAPTLMNAMEN1
SCHEMBL29929929 0.88 MAPT (0.60) PDK2SMN1; SMN2MAPTLMNAMEN1
SCHEMBL23567189 0.88 MAPT (0.65) PDK2SMN1; SMN2MAPTLMNAMEN1
SCHEMBL808149 0.85 SMN1; SMN2 (0.61) PDK2SMN1; SMN2MAPTLMNAMEN1
SCHEMBL15695611 0.85 SMN1; SMN2 (0.61) PDK2SMN1; SMN2MAPTLMNAMEN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230180492-A1 ORGANIC ELECTROLUMINESCENT DEVICE Beijing Summer Sprout Technology Co., Ltd. (CN) 2023-06-08 US disclosed
CN-111170874-B Arylamine compound and organic electroluminescent device thereof 长春海谱润斯科技股份有限公司 2021-02-26 CN disclosed
CN-111170874-A Arylamine compound and organic electroluminescent device thereof 长春海谱润斯科技有限公司 2020-05-19 CN disclosed