SCHEMBL19786485

SCHEMBL19786485

O=C(CCCc1ccc2ccc3cccc4ccc1c2c34)NCO

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.67
MEN1 O00255 3/20 0.67
ITPR1 Q14643 1/20 0.50
FAAH O00519 1/20 0.42
MTNR1A P48039 5/20 0.41
MTNR1B P49286 2/20 0.41
KDM4E B2RXH2 4/20 0.41
ALDH1A1 P00352 4/20 0.41
HPGD P15428 2/20 0.41
CYP1A2 P05177 1/20 0.41
GLA P06280 1/20 0.41
POLB P06746 1/20 0.41
CYP2D6 P10635 1/20 0.41
HSD17B10 Q99714 1/20 0.41
GAA P10253 1/20 0.41
HTT P42858 1/20 0.41
NPY1R P25929 1/20 0.41
MAPT P10636 2/20 0.40
LMNA P02545 1/20 0.37
MAPK1 P28482 1/20 0.37

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
SCHEMBL30730869 0.89 KMT2A (0.72) KMT2AMEN1ITPR1FAAHMTNR1A
SCHEMBL14940077 0.89 KMT2A (0.67) KMT2AMEN1ITPR1FAAHMTNR1A
SCHEMBL31713966 0.85 KMT2A (0.66) KMT2AMEN1ITPR1FAAHMTNR1A
SCHEMBL29369373 0.84 KMT2A (0.68) KMT2AMEN1ITPR1FAAHMTNR1A
SCHEMBL1714410 0.84 KMT2A (0.68) KMT2AMEN1ITPR1FAAHMTNR1A
SCHEMBL29367001 0.84 MEN1 (0.60) KMT2AMEN1ITPR1FAAHMTNR1A
SCHEMBL15732870 0.84 KMT2A (0.60) KMT2AMEN1ITPR1FAAHMTNR1A
SCHEMBL17440482 0.84 MEN1 (0.60) KMT2AMEN1ITPR1FAAHMTNR1A
SCHEMBL15890186 0.82 ITPR1 (0.60) KMT2AMEN1ITPR1MTNR1AMTNR1B
SCHEMBL24425463 0.82 KMT2A (0.65) KMT2AMEN1ITPR1FAAHMTNR1A

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
WO-2018013999-A1 NON-NUCLEOSIDIC SOLID SUPPORTS AND PHOSPHORAMIDITE BUILDING BLOCKS FOR OLIGONUCLEOTIDE SYNTHESIS AM CHEMICALS LLC (US) 2018-01-18 WO disclosed