SCHEMBL1737211

SCHEMBL1737211

CCC1c2ccccc2CCN1c1nccc2c(C)c(C)n(COC)c12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
LMNA P02545 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
NTRK1 P04629 2/20 0.31
PPARG P37231 1/20 0.31
CYP1A2 P05177 1/20 0.31
CHRM2 P08172 1/20 0.31
HTR1A P08908 1/20 0.31
ADRA2A P08913 1/20 0.31
CYP2D6 P10635 1/20 0.31
CHRM1 P11229 1/20 0.31
CYP2C9 P11712 1/20 0.31
TSHR P16473 1/20 0.31
ADRA2B P18089 1/20 0.31
ADRA2C P18825 1/20 0.31
DRD1 P21728 1/20 0.31
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
CYP2C19 P33261 1/20 0.31

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 SCHEMBL1736448 0.99 PPARG (0.32) MEN1KMT2ALMNATDP1NTRK1
SCHEMBL1737075 0.92 PPARG (0.31) NTRK1PPARGPRMT5WDR77
Hydrochloric Acid SCHEMBL1736606 0.91 PPARG (0.32) PPARG
SCHEMBL1737520 0.90 NTRK1 (0.34) MEN1KMT2ALMNATDP1NTRK1
SCHEMBL1737283 0.90 MEN1 (0.35) MEN1KMT2ALMNATDP1NTRK1
Hydrochloric Acid SCHEMBL1737217 0.90 NTRK1 (0.34) MEN1KMT2ALMNATDP1NTRK1
Hydrochloric Acid SCHEMBL1736961 0.89 MEN1 (0.34) MEN1KMT2ALMNATDP1NTRK1
SCHEMBL1737872 0.86 FABP4 (0.39) MEN1KMT2ALMNATDP1TSHR
Hydrochloric Acid SCHEMBL1737082 0.85 FABP4 (0.38) MEN1KMT2ALMNATDP1TSHR
SCHEMBL1737403 0.85 PRCP (0.36) MEN1KMT2ALMNATDP1CYP1A2

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