SCHEMBL23657200

SCHEMBL23657200

COCCCn1cnc(C)c1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
FDPS P14324 1/20 0.42
SMN1; SMN2 Q16637 5/20 0.42
HSD17B10 Q99714 3/20 0.42
ALDH1A1 P00352 3/20 0.42
KDM4E B2RXH2 2/20 0.42
HPGD P15428 2/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
GLA P06280 1/20 0.42
GAA P10253 1/20 0.42
POLB P06746 1/20 0.37
MAPT P10636 4/20 0.36
LMNA P02545 4/20 0.34
NPSR1 Q6W5P4 1/20 0.34
HTT P42858 3/20 0.34
STAT3 P40763 1/20 0.34
TP53 P04637 1/20 0.33
PDE4A P27815 2/20 0.33

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
SCHEMBL25493698 0.82 MAPK13 (0.44) MEN1KMT2AFDPSSMN1; SMN2HSD17B10
SCHEMBL25493037 0.81 FDPS (0.36) MEN1KMT2AFDPSSMN1; SMN2HSD17B10
SCHEMBL7037181 0.79 LMNA (0.51) MEN1KMT2AFDPSALDH1A1KDM4E
SCHEMBL8443845 0.77 FDPS (0.41) KMT2AFDPSHSD17B10ALDH1A1HPGD
SCHEMBL11534686 0.76 FDPS (0.43) MEN1KMT2AFDPSHSD17B10ALDH1A1
SCHEMBL20011271 0.74 FDPS (0.44) KMT2AFDPSSMN1; SMN2ALDH1A1POLB
SCHEMBL23657286 0.73 MAPT (0.58) MEN1KMT2ASMN1; SMN2HSD17B10ALDH1A1
SCHEMBL16479467 0.72 FDPS (0.43) FDPSHSD17B10ALDH1A1HPGDLMNA
SCHEMBL19611492 0.72 FDPS (0.47) FDPSSMN1; SMN2HSD17B10ALDH1A1HPGD
SCHEMBL13403286 0.72 FDPS (0.43) FDPSHSD17B10ALDH1A1HPGDLMNA

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-2021145729-A1 NOVEL COMPOUND, PREPARATION METHOD THEREOF, AND USE THEREOF DAEGU-GYEONGBUK MEDICAL INNOVATION FOUNDATION (KR) 2021-07-22 WO disclosed