SCHEMBL2851891

SCHEMBL2851891

CP(C)c1ccccc1Nc1ccccc1P(C)C

nearest known ligand 0.31

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.31
ALDH1A1 P00352 4/20 0.31
TDP1 Q9NUW8 3/20 0.31
KDM4E B2RXH2 3/20 0.31
RECQL P46063 3/20 0.31
GAA P10253 3/20 0.31
MEN1 O00255 3/20 0.31
KMT2A Q03164 3/20 0.31
HTT P42858 1/20 0.31
GLA P06280 1/20 0.31
USP2 O75604 1/20 0.31
POLB P06746 1/20 0.31
HPGD P15428 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
HSD17B10 Q99714 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
LMNA P02545 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
MAPK10 P53779 1/20 0.30
GFER P55789 1/20 0.30

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
SCHEMBL30480021 0.76 TSHR (0.35) TDP1LMNACYP1A2
SCHEMBL11159228 0.76 TSHR (0.35) TDP1LMNACYP1A2
SCHEMBL3002500 0.76 TSHR (0.35) TDP1LMNACYP1A2
SCHEMBL2850128 0.73 MEN1 (0.31) TDP1MEN1KMT2AL3MBTL1
SCHEMBL2850176 0.73 ALDH1A1 (0.31) ALDH1A1TDP1RECQLKMT2AHSD17B10
SCHEMBL946616 0.73 KMT2A (0.33) MAPTALDH1A1TDP1GAAMEN1
SCHEMBL2851865 0.70 MAPK1 (0.31) MAPTHTT
SCHEMBL2044796 0.70 TDP1 (0.50) MAPTALDH1A1TDP1KDM4ERECQL
SCHEMBL22520101 0.70 LRRK2 (0.38) KDM4EKMT2AHSD17B10
SCHEMBL21558104 0.69 BCL6 (0.58) KMT2AMAPK10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8436111-B2 Nickel catalyst system for the preparation of high CIS polybutadiene BRIDGESTONE CORPORATION (JP) 2013-05-07 US claimed
US-20100093920-A1 NICKEL CATALYST SYSTEM FOR THE PREPARATION OF HIGH CIS POLYBUTADIENE BRIDGESTONE CORPORATION (JP) 2010-04-15 US claimed
US-8436111-B2 Nickel catalyst system for the preparation of high CIS polybutadiene BRIDGESTONE CORPORATION (JP) 2013-05-07 US disclosed
US-20100093920-A1 NICKEL CATALYST SYSTEM FOR THE PREPARATION OF HIGH CIS POLYBUTADIENE BRIDGESTONE CORPORATION (JP) 2010-04-15 US disclosed