SCHEMBL6962863

SCHEMBL6962863

Cc1nc(Nc2ccc(F)cc2)nc(N2CCc3cc(OC(=O)c4ccccc4Cl)ccc3C2C)c1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.38
MEN1 O00255 3/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
POLB P06746 2/20 0.35
MAPT P10636 2/20 0.35
KDM4E B2RXH2 1/20 0.35
LMNA P02545 1/20 0.35
HPGD P15428 1/20 0.35
STAT3 P40763 1/20 0.35
HTT P42858 1/20 0.35
ESR1 P03372 1/20 0.34
PKM P14618 1/20 0.34
ESR2 Q92731 1/20 0.34
TDP1 Q9NUW8 1/20 0.33
RORC P51449 3/20 0.33
NR1I2 O75469 1/20 0.33
RORA P35398 1/20 0.33
NR1H2 P55055 1/20 0.33
NR1H3 Q13133 1/20 0.33
RORB Q92753 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
SCHEMBL6961880 0.94 KMT2A (0.38) KMT2AMEN1SMN1; SMN2POLBMAPT
SCHEMBL6962832 0.91 NR1D1 (0.34) KMT2AMEN1SMN1; SMN2MAPTKDM4E
SCHEMBL6958073 0.91 KMT2A (0.33) KMT2ASMN1; SMN2MAPTRORCLCK
SCHEMBL6963254 0.90 TP53 (0.33) KMT2ASMN1; SMN2MAPTRORCNR1I2
SCHEMBL6961464 0.89 HIF1A (0.38) KMT2AMEN1SMN1; SMN2MAPTLMNA
SCHEMBL6964427 0.89 KMT2A (0.35) KMT2AMEN1SMN1; SMN2MAPTRORC
SCHEMBL6961412 0.89 SMN1; SMN2 (0.37) KMT2ASMN1; SMN2MAPTLMNAHTT
SCHEMBL6957084 0.89 KMT2A (0.33) KMT2ASMN1; SMN2MAPTLCKNPSR1
SCHEMBL6957582 0.88 CCNE1 (0.39) MAPTKDM4ENPSR1CDK2CCNE1
SCHEMBL6963362 0.88 KMT2A (0.34) KMT2AMEN1SMN1; SMN2MAPTRORC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1015444-B1 PYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORP LTD (KR) 2003-05-28 EP claimed
EP-1015444-B1 PYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORP LTD (KR) 2003-05-28 EP disclosed
US-6352993-B1 ANTIULCER AGENTS YUHAN CORPORATION (KR) 2002-03-05 US disclosed
EP-1015444-A1 NOVEL PYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION, LTD. (KR) 2000-07-05 EP disclosed
WO-1998043968-A1 NOVEL PYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 1998-10-08 WO disclosed