SCHEMBL6959667

SCHEMBL6959667

CCc1nc(OC)c(NC(=O)N2CCN(c3cc(C)cc(C)c3)CC2)cc1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PHGDH O43175 3/20 0.42
KMT2A Q03164 4/20 0.40
GAA P10253 1/20 0.40
RBP4 P02753 1/20 0.40
MAPT P10636 3/20 0.39
LMNA P02545 3/20 0.39
ALDH1A1 P00352 2/20 0.39
MAPK1 P28482 2/20 0.39
TP53 P04637 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
DGAT1 O75907 1/20 0.38
THRB P10828 1/20 0.38
PI4KB Q9UBF8 1/20 0.38
CYP3A4 P08684 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
MEN1 O00255 1/20 0.38
USP2 O75604 1/20 0.38

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
SCHEMBL6956612 0.92 PHGDH (0.40) PHGDHKMT2AGAARBP4MAPT
SCHEMBL6961290 0.91 KMT2A (0.46) PHGDHKMT2AGAARBP4MAPT
SCHEMBL5390083 0.89 HCAR2 (0.41) PHGDHKMT2AGAARBP4MAPT
SCHEMBL6963524 0.87 KMT2A (0.43) PHGDHKMT2AGAARBP4MAPT
SCHEMBL6956284 0.86 RBP4 (0.43) PHGDHKMT2AGAARBP4MAPT
SCHEMBL6958269 0.85 GAA (0.48) KMT2AGAARBP4MAPTLMNA
SCHEMBL5395201 0.83 HCAR2 (0.40) PHGDHKMT2AGAARBP4MAPT
SCHEMBL6956121 0.83 KMT2A (0.45) PHGDHKMT2AGAARBP4MAPT
SCHEMBL6964806 0.82 KMT2A (0.39) PHGDHKMT2AGAARBP4MAPT
SCHEMBL6651807 0.81 MAPT (0.48) PHGDHKMT2AGAAMAPTLMNA

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
EP-0850222-B1 PIPERAZINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF SAMJIN PHARM CO LTD (KR) 2003-05-28 EP disclosed
US-6028195-A AN ANTITUMOR AGENT WITH VERY LOW TOXICITIES SAMJIN PHARMACEUTICAL CO., LTD. (KR) 2000-02-22 US disclosed