SCHEMBL1735360

SCHEMBL1735360

Cc1ccc(CNc2nccc3c(C)c(C)n(CC4CC4)c23)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
WNT3A P56704 3/20 0.38
MERTK Q12866 1/20 0.38
MAPT P10636 1/20 0.37
KDM4E B2RXH2 4/20 0.36
LMNA P02545 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
POLB P06746 1/20 0.35
ALDH1A1 P00352 3/20 0.35
HPGD P15428 1/20 0.35
ACHE P22303 1/20 0.35
BACE1 P56817 1/20 0.35
HSD17B10 Q99714 2/20 0.34
HTT P42858 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
APP P05067 1/20 0.34
PRMT1 Q99873 1/20 0.34
CCNE2 O96020 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
Hydrochloric Acid SCHEMBL1736693 0.99 WNT3A (0.38) WNT3AMERTKMAPTKDM4ELMNA
SCHEMBL3846872 0.91 KDM4E (0.42) MERTKKDM4EMEN1KMT2AALDH1A1
Hydrochloric Acid SCHEMBL1736593 0.90 LRRK2 (0.42) MAPTKDM4ELMNAPOLBALDH1A1
Hydrochloric Acid SCHEMBL1736667 0.90 CYP1A2 (0.39) MERTKMAPTKDM4EMEN1KMT2A
Hydrochloric Acid SCHEMBL1735789 0.90 KDM4E (0.42) MERTKKDM4ELMNAMEN1KMT2A
SCHEMBL3842136 0.84 WNT3A (0.41) WNT3AMAPTKDM4ELMNAMEN1
Hydrochloric Acid SCHEMBL1735583 0.83 WNT3A (0.41) WNT3AMAPTKDM4ELMNAMEN1
Hydrochloric Acid SCHEMBL1738473 0.83 WNT3A (0.41) WNT3AMAPTKDM4ELMNAMEN1
SCHEMBL3846187 0.82 MEN1 (0.40) WNT3AMAPTKDM4ELMNAMEN1
SCHEMBL27698493 0.82 WNT3A (0.40) WNT3AMAPTKDM4ELMNAMEN1

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 disclosed
US-20110263306-A1 COMPUTER SYSTEM AND PROGRAM NAMCO BANDAI GAMES INC. (JP) 2011-10-27 US disclosed