SCHEMBL28831773

SCHEMBL28831773

CCCCCCCCCCCCOc1ccccc1C(=O)O.[Mo]

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.72
MEN1 O00255 2/20 0.72
LMNA P02545 2/20 0.72
CYP3A4 P08684 2/20 0.72
NR1I2 O75469 1/20 0.72
CHRM2 P08172 1/20 0.72
ADRA2A P08913 1/20 0.72
MAPT P10636 1/20 0.72
OPRK1 P41145 1/20 0.72
HTR2B P41595 1/20 0.72
SLC6A3 Q01959 1/20 0.72
HDAC6 Q9UBN7 1/20 0.72
PTPN11 Q06124 6/20 0.67
ALDH1A1 P00352 4/20 0.63
PTK2B Q14289 1/20 0.63
NPSR1 Q6W5P4 1/20 0.60
KDM4E B2RXH2 1/20 0.59
RECQL P46063 1/20 0.59
PTPN1 P18031 3/20 0.58
S1PR3 Q99500 1/20 0.58

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
SCHEMBL28219879 1.00 KMT2A (0.72) KMT2AMEN1LMNACYP3A4NR1I2
SCHEMBL28219873 1.00 KMT2A (0.72) KMT2AMEN1LMNACYP3A4NR1I2
SCHEMBL28220415 0.98 LMNA (0.69) KMT2AMEN1LMNACYP3A4NR1I2
SCHEMBL2044840 0.98 KMT2A (0.74) KMT2AMEN1LMNACYP3A4NR1I2
SCHEMBL168816 0.98 KMT2A (0.74) KMT2AMEN1LMNACYP3A4NR1I2
SCHEMBL112985 0.98 KMT2A (0.74) KMT2AMEN1LMNACYP3A4NR1I2
SCHEMBL18140779 0.98 KMT2A (0.74) KMT2AMEN1LMNACYP3A4NR1I2
SCHEMBL527254 0.98 KMT2A (0.74) KMT2AMEN1LMNACYP3A4NR1I2
SCHEMBL18141371 0.98 KMT2A (0.74) KMT2AMEN1LMNACYP3A4NR1I2
SCHEMBL342176 0.98 KMT2A (0.74) KMT2AMEN1LMNACYP3A4NR1I2

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
CN-105802166-A Toughened polylactic acid/polybutylene alloy material and preparation method thereof 王泽陆 2016-07-27 CN claimed
CN-105802166-A Toughened polylactic acid/polybutylene alloy material and preparation method thereof 王泽陆 2016-07-27 CN disclosed