SCHEMBL1736047

SCHEMBL1736047

Cc1ccc(OCc2nccc3c(C)c(C)n(Cc4ccccc4F)c23)c(C)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.37
L3MBTL1 Q9Y468 4/20 0.37
LMNA P02545 3/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
MAPK1 P28482 2/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
HPGD P15428 1/20 0.37
TSHR P16473 1/20 0.37
CASP3 P42574 1/20 0.37
SENP8 Q96LD8 1/20 0.37
SENP7 Q9BQF6 1/20 0.37
SENP6 Q9GZR1 1/20 0.37
CHRM1 P11229 1/20 0.36
PTPN22 Q9Y2R2 1/20 0.35
ALDH1A1 P00352 5/20 0.35
THRB P10828 1/20 0.35
PLA2G2A P14555 2/20 0.35
HTT P42858 1/20 0.34
TDP1 Q9NUW8 1/20 0.34

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 SCHEMBL1737863 0.99 MAPT (0.36) MAPTL3MBTL1LMNASMN1; SMN2MAPK1
SCHEMBL1737385 0.87 FABP4 (0.41) MAPTL3MBTL1LMNASMN1; SMN2MAPK1
Hydrochloric Acid SCHEMBL1737640 0.86 FABP4 (0.41) MAPTL3MBTL1LMNASMN1; SMN2MAPK1
SCHEMBL1737014 0.84 L3MBTL1 (0.39) MAPTL3MBTL1LMNASMN1; SMN2MAPK1
SCHEMBL1737046 0.84 L3MBTL1 (0.37) MAPTL3MBTL1HPGDTSHRKMT2A
Hydrochloric Acid SCHEMBL1736511 0.83 L3MBTL1 (0.39) MAPTL3MBTL1LMNASMN1; SMN2MAPK1
SCHEMBL1739157 0.83 L3MBTL1 (0.39) MAPTL3MBTL1LMNASMN1; SMN2MAPK1
Hydrochloric Acid SCHEMBL1736306 0.83 L3MBTL1 (0.37) MAPTL3MBTL1HPGDTSHRKMT2A
Hydrochloric Acid SCHEMBL1737642 0.82 L3MBTL1 (0.38) MAPTL3MBTL1LMNASMN1; SMN2MAPK1
SCHEMBL1737378 0.81 NPC1 (0.39) MAPTSMN1; SMN2MAPK1NPC1RAB9A

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