SCHEMBL28448490

SCHEMBL28448490

[CH2]Cc1c(C)c(C)c2c(c1C)C=C[C@@](C)(CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)O2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.40
TTPA P49638 3/20 0.40
MAPT P10636 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
GSTP1 P09211 1/20 0.40
USP2 O75604 1/20 0.40
THRB P10828 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
PDE4A P27815 1/20 0.36
PDE3A Q14432 1/20 0.36
GSTO1 P78417 2/20 0.36
PSEN1 P49768 2/20 0.35
AKT1 P31749 5/20 0.34
PDPK1 O15530 2/20 0.34
PHLPP1 O60346 2/20 0.34
ILK Q13418 2/20 0.34
PTPN1 P18031 2/20 0.34
NR1I2 O75469 1/20 0.33

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
SCHEMBL28444734 0.84 PSEN1 (0.43) LMNATTPAMAPTMEN1KMT2A
SCHEMBL28454235 0.84 PSEN1 (0.43) LMNATTPAMAPTMEN1KMT2A
SCHEMBL28454237 0.84 PSEN1 (0.43) LMNATTPAMAPTMEN1KMT2A
SCHEMBL28444736 0.84 PSEN1 (0.43) LMNATTPAMAPTMEN1KMT2A
SCHEMBL9285268 0.83 LMNA (0.55) LMNATTPAMAPTMEN1KMT2A
SCHEMBL21929589 0.83 LMNA (0.55) LMNATTPAMAPTMEN1KMT2A
SCHEMBL21931412 0.83 LMNA (0.55) LMNATTPAMAPTMEN1KMT2A
SCHEMBL21929591 0.83 LMNA (0.55) LMNATTPAMAPTMEN1KMT2A
SCHEMBL21931411 0.83 LMNA (0.55) LMNATTPAMAPTMEN1KMT2A
SCHEMBL21131789 0.83 LMNA (0.55) LMNATTPAMAPTMEN1KMT2A

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
CN-105473567-B Formation of chromanes and chromenes by using silver (I) or gold (I) salts or complexes 帝斯曼知识产权资产管理有限公司 2020-07-31 CN disclosed