SCHEMBL1737601

SCHEMBL1737601

Cc1c(C)n(CC(C)C)c2c(N3CCc4ccccc4C3)nc(C(=O)N3CCN(C)CC3)cc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
RECQL P46063 1/20 0.40
TAAR1 Q96RJ0 1/20 0.39
ALDH1A1 P00352 6/20 0.38
LMNA P02545 4/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
HTT P42858 2/20 0.38
CRHBP P24387 1/20 0.38
CRHR2 Q13324 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HRH4 Q9H3N8 1/20 0.36
PRMT5 O14744 1/20 0.36
WDR77 Q9BQA1 1/20 0.36
TSHR P16473 2/20 0.35
SPR P35270 1/20 0.35
HPGD P15428 2/20 0.35
HDAC6 Q9UBN7 1/20 0.35
RAB9A P51151 1/20 0.35
KDM4E B2RXH2 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 SCHEMBL1735612 0.99 MEN1 (0.40) MEN1KMT2ARECQLTAAR1ALDH1A1
SCHEMBL1737733 0.93 MEN1 (0.41) MEN1KMT2ARECQLTAAR1ALDH1A1
Hydrochloric Acid SCHEMBL1737611 0.92 MEN1 (0.40) MEN1KMT2ARECQLTAAR1ALDH1A1
SCHEMBL1739484 0.92 MEN1 (0.40) MEN1KMT2ARECQLTAAR1ALDH1A1
Hydrochloric Acid SCHEMBL1736726 0.91 KMT2A (0.39) MEN1KMT2ARECQLTAAR1ALDH1A1
SCHEMBL1739692 0.90 MEN1 (0.48) MEN1KMT2ARECQLALDH1A1LMNA
Hydrochloric Acid SCHEMBL1738970 0.90 MEN1 (0.48) MEN1KMT2ARECQLALDH1A1LMNA
SCHEMBL1737533 0.90 MEN1 (0.44) MEN1KMT2ARECQLTAAR1ALDH1A1
Hydrochloric Acid SCHEMBL1737659 0.89 MEN1 (0.43) MEN1KMT2ARECQLTAAR1ALDH1A1
SCHEMBL1737489 0.88 TAAR1 (0.40) MEN1KMT2ATAAR1ALDH1A1LMNA

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