SCHEMBL24129397

SCHEMBL24129397

Cc1cnc2ncnn2c1N1CCCC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.42
PAX2 Q02962 1/20 0.41
SMN1; SMN2 Q16637 5/20 0.39
MAPT P10636 5/20 0.39
TSHR P16473 3/20 0.39
ALDH1A1 P00352 4/20 0.37
TP53 P04637 3/20 0.37
HSD17B10 Q99714 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
NPSR1 Q6W5P4 2/20 0.37
EGLN2 Q96KS0 2/20 0.37
KDM4E B2RXH2 1/20 0.37
HPGD P15428 1/20 0.37
USP2 O75604 1/20 0.37
ALOX15 P16050 1/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 2/20 0.36
RECQL P46063 1/20 0.36
ROCK2 O75116 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
SCHEMBL24129343 0.75 PAX2 (0.63) LMNAPAX2SMN1; SMN2MAPTTSHR
SCHEMBL24129395 0.73 PAX2 (0.61) LMNAPAX2SMN1; SMN2MAPTTSHR
SCHEMBL24129361 0.72 SMN1; SMN2 (0.48) LMNAPAX2SMN1; SMN2MAPTTSHR
SCHEMBL24129095 0.72 PAX2 (0.47) LMNAPAX2SMN1; SMN2MAPTTSHR
SCHEMBL24129236 0.71 PAX2 (0.63) LMNAPAX2SMN1; SMN2MAPTTSHR
SCHEMBL15688284 0.71 ALDH1A1 (0.42) LMNASMN1; SMN2MAPTTSHRALDH1A1
SCHEMBL7196374 0.71 ALDH1A1 (0.40) LMNASMN1; SMN2MAPTTSHRALDH1A1
SCHEMBL14271007 0.70 KDM4E (0.51) LMNAPAX2SMN1; SMN2MAPTTSHR
SCHEMBL24129190 0.70 PAX2 (0.45) LMNAPAX2SMN1; SMN2MAPTTSHR
SCHEMBL24129416 0.68 SMN1; SMN2 (0.50) LMNAPAX2SMN1; SMN2MAPTTSHR

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-2021257614-A1 HETEROCYCLIC INHIBITORS OF ENPP1 VOLASTRA THERAPEUTICS, INC. (US) 2021-12-23 WO disclosed