SCHEMBL1737548

SCHEMBL1737548

COCCn1c(C)c(C)c2cc(C(=O)N3CCN(C)CC3)nc(N3CCc4ccccc4C3)c21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.40
POLB P06746 1/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
ALDH1A1 P00352 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
MAPT P10636 2/20 0.40
HPGD P15428 4/20 0.39
RECQL P46063 1/20 0.39
LMNA P02545 2/20 0.37
NAMPT P43490 1/20 0.36
KDM4E B2RXH2 3/20 0.36
GLA P06280 1/20 0.36
GAA P10253 1/20 0.36
HSD17B10 Q99714 1/20 0.36
PTK2B Q14289 1/20 0.36
TSHR P16473 1/20 0.36
HRH4 Q9H3N8 1/20 0.36
ADRA1A P35348 1/20 0.35
SPR P35270 1/20 0.35

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 SCHEMBL1735978 0.99 POLB (0.40) SMN1; SMN2POLBMEN1KMT2AALDH1A1
SCHEMBL1739249 0.94 SMN1; SMN2 (0.40) SMN1; SMN2POLBMEN1KMT2AALDH1A1
Hydrochloric Acid SCHEMBL1738845 0.93 SMN1; SMN2 (0.39) SMN1; SMN2POLBMEN1KMT2AALDH1A1
SCHEMBL1737533 0.91 MEN1 (0.44) SMN1; SMN2MEN1KMT2AALDH1A1MAPT
Hydrochloric Acid SCHEMBL1737659 0.90 MEN1 (0.43) SMN1; SMN2MEN1KMT2AALDH1A1MAPT
SCHEMBL1736553 0.90 HPGD (0.41) SMN1; SMN2POLBMEN1KMT2AALDH1A1
SCHEMBL1739692 0.90 MEN1 (0.48) SMN1; SMN2MEN1KMT2AALDH1A1MAPT
SCHEMBL1737878 0.89 MEN1 (0.41) SMN1; SMN2POLBMEN1KMT2AALDH1A1
Hydrochloric Acid SCHEMBL1738970 0.89 MEN1 (0.48) SMN1; SMN2MEN1KMT2AALDH1A1MAPT
SCHEMBL1738004 0.87 MEN1 (0.42) SMN1; SMN2MEN1KMT2AALDH1A1MAPT

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