SCHEMBL5811658

SCHEMBL5811658

C=CCn1c(C)c(C)c2ccnc(Oc3ccc4oc5ccccc5c4c3)c21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.46
MAPT P10636 3/20 0.46
LMNA P02545 3/20 0.40
NPSR1 Q6W5P4 3/20 0.37
RXFP1 Q9HBX9 1/20 0.37
PTGER4 P35408 1/20 0.36
ALDH1A1 P00352 4/20 0.36
RAB9A P51151 2/20 0.36
TP53 P04637 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
GAA P10253 2/20 0.36
HPGD P15428 2/20 0.36
SIRT2 Q8IXJ6 1/20 0.36
SIRT1 Q96EB6 1/20 0.36
USP2 O75604 2/20 0.36
HCRTR1 O43613 3/20 0.35
HCRTR2 O43614 2/20 0.35
POLB P06746 2/20 0.34
KDM4E B2RXH2 1/20 0.34
TSHR P16473 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 SCHEMBL5808644 0.99 NPC1 (0.46) NPC1MAPTLMNANPSR1RXFP1
SCHEMBL5806150 0.89 MAPT (0.49) NPC1MAPTLMNANPSR1RXFP1
Hydrochloric Acid SCHEMBL5811160 0.89 MAPT (0.43) NPC1MAPTLMNANPSR1RXFP1
Hydrochloric Acid SCHEMBL5810209 0.88 MAPT (0.48) NPC1MAPTLMNANPSR1RXFP1
Hydrochloric Acid SCHEMBL5806692 0.86 MAPT (0.46) NPC1MAPTLMNANPSR1RXFP1
Hydrochloric Acid SCHEMBL5808654 0.86 MAPT (0.46) NPC1MAPTLMNANPSR1RXFP1
SCHEMBL5806149 0.86 NPC1 (0.46) NPC1MAPTLMNANPSR1RXFP1
Hydrochloric Acid SCHEMBL5809237 0.85 NPC1 (0.45) NPC1MAPTLMNANPSR1RXFP1
Hydrochloric Acid SCHEMBL5810820 0.85 NPC1 (0.45) NPC1MAPTLMNANPSR1RXFP1
Hydrochloric Acid SCHEMBL5806436 0.84 MAPT (0.44) NPC1MAPTLMNANPSR1RXFP1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2006025717-A1 PYRROLO[2,3-c]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 2006-03-09 WO claimed