SCHEMBL27614533

SCHEMBL27614533

CCCCPC(=O)c1c(C)cc(C)cc1C.[LiH]

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.38
POLB P06746 1/20 0.38
MEN1 O00255 1/20 0.37
LMNA P02545 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
KDM4E B2RXH2 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
ALDH1A1 P00352 2/20 0.34
CRHR1 P34998 1/20 0.34
ITGB1 P05556 1/20 0.34
ITGA4 P13612 1/20 0.34
NR1I2 O75469 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
THRA P10827 1/20 0.32
THRB P10828 1/20 0.32
TAS1R3 Q7RTX0 2/20 0.32
TAS1R1 Q7RTX1 2/20 0.32
TAS1R2 Q8TE23 2/20 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
SCHEMBL5995072 0.98 HPGD (0.39) HPGDPOLBMEN1LMNAKMT2A
SCHEMBL27614447 0.83 PLA2G2A (0.36) ALDH1A1MAPTTHRATHRBESR1
SCHEMBL5996113 0.83 NR5A2 (0.40) HPGDPOLBMEN1KMT2ASMN1; SMN2
SCHEMBL28751427 0.83 PLA2G2A (0.38) HPGDALDH1A1NR1I2MAPTESR1
SCHEMBL5993504 0.81 PLA2G2A (0.37) ALDH1A1MAPTTHRATHRBESR1
SCHEMBL5998257 0.81 F2R (0.38) MEN1KMT2ASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL5996417 0.81 PLA2G2A (0.39) HPGDALDH1A1NR1I2MAPTTHRA
SCHEMBL3870505 0.80 HPGD (0.42) HPGDMEN1LMNAKMT2ASMN1; SMN2
SCHEMBL5997283 0.79 L3MBTL1 (0.38) POLBMEN1LMNAKMT2ASMN1; SMN2
SCHEMBL5994553 0.76 PLA2G2A (0.34) HPGDMEN1KMT2ASMN1; SMN2ALDH1A1

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-1589276-A Multimer of acylphosphines and their derivatives CIBA SC HOLDING AG (CH) 2005-03-02 CN disclosed