SCHEMBL1738256

SCHEMBL1738256

Cc1c(C)n(CC(C)C)c2c(N3CCc4ccccc4C3)nc(OC(=O)O)cc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.39
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
ALDH1A1 P00352 5/20 0.37
LMNA P02545 4/20 0.37
HTT P42858 3/20 0.37
CRHBP P24387 1/20 0.37
CRHR2 Q13324 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
HPGD P15428 5/20 0.36
KDM4E B2RXH2 4/20 0.36
MAPT P10636 4/20 0.36
GRIN2D O15399 2/20 0.36
GRIN3B O60391 2/20 0.36
GRIN1 Q05586 2/20 0.36
GRIN2A Q12879 2/20 0.36
GRIN2B Q13224 2/20 0.36
GRIN2C Q14957 2/20 0.36
GRIN3A Q8TCU5 2/20 0.36

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
SCHEMBL1737274 0.90 MEN1 (0.46) MEN1KMT2AALDH1A1LMNAHTT
SCHEMBL1739778 0.88 MEN1 (0.40) TAAR1MEN1KMT2AALDH1A1LMNA
SCHEMBL1738134 0.88 FABP4 (0.41) MEN1KMT2AALDH1A1HTTSMN1; SMN2
SCHEMBL1738556 0.87 MEN1 (0.39) MEN1KMT2AALDH1A1LMNAHTT
SCHEMBL1736555 0.87 HPGD (0.40) MEN1KMT2AALDH1A1LMNAHTT
SCHEMBL1738151 0.87 MDM2 (0.39) MEN1KMT2AALDH1A1HTTSMN1; SMN2
SCHEMBL1737489 0.86 TAAR1 (0.40) TAAR1MEN1KMT2AALDH1A1LMNA
SCHEMBL1738167 0.84 PRMT5 (0.41) MEN1KMT2AALDH1A1LMNAHTT
SCHEMBL1735927 0.84 USP2 (0.40) MEN1KMT2AALDH1A1LMNASMN1; SMN2
SCHEMBL1737171 0.84 TAAR1 (0.40) TAAR1MEN1KMT2AALDH1A1LMNA

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-1784404-B1 PYRROLO[2,3-C]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORP (KR) 2011-11-16 EP claimed
US-20110263306-A1 COMPUTER SYSTEM AND PROGRAM NAMCO BANDAI GAMES INC. (JP) 2011-10-27 US claimed