SCHEMBL24569205

SCHEMBL24569205

CC(=O)N1CCCC(C)(O)CC1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 5/20 0.43
ALDH1A1 P00352 5/20 0.43
CYP2D6 P10635 4/20 0.43
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
CYP1A2 P05177 3/20 0.41
TDP1 Q9NUW8 1/20 0.41
CYP3A4 P08684 4/20 0.41
CYP2C19 P33261 4/20 0.41
HIF1A Q16665 1/20 0.41
CYP2C9 P11712 4/20 0.40
TSHR P16473 2/20 0.40
HPGD P15428 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
KDM4E B2RXH2 1/20 0.39
USP2 O75604 3/20 0.39
EPHX2 P34913 1/20 0.39
MAPK1 P28482 1/20 0.38
ALOX15 P16050 1/20 0.37

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
SCHEMBL24747145 1.00 HSD17B10 (0.43) HSD17B10ALDH1A1CYP2D6MEN1KMT2A
SCHEMBL5518371 0.91 CYP1A2 (0.48) HSD17B10ALDH1A1CYP2D6MEN1KMT2A
SCHEMBL4550437 0.83 CYP3A4 (0.43) HSD17B10ALDH1A1CYP2D6MEN1KMT2A
SCHEMBL23817652 0.81 EPHX2 (0.47) HSD17B10ALDH1A1CYP2D6MEN1KMT2A
SCHEMBL14297361 0.78 SMN1; SMN2 (0.43) HSD17B10ALDH1A1CYP2D6MEN1KMT2A
SCHEMBL18478135 0.78 SMN1; SMN2 (0.43) HSD17B10ALDH1A1CYP2D6MEN1KMT2A
SCHEMBL18478136 0.78 SMN1; SMN2 (0.43) HSD17B10ALDH1A1CYP2D6MEN1KMT2A
SCHEMBL23817654 0.78 CYP1A2 (0.40) HSD17B10ALDH1A1CYP2D6MEN1KMT2A
SCHEMBL23145122 0.77 ALDH1A1 (0.46) ALDH1A1MEN1KMT2ATDP1SMN1; SMN2
SCHEMBL24962059 0.76 FFAR3 (0.48) HSD17B10ALDH1A1CYP2D6MEN1KMT2A

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
WO-2022137082-A1 PYRROLO[3,2-B]PYRIDINE DERIVATIVES USEFUL IN TREATING CONDITIONS ASSOCIATED WITH CGAS NOVARTIS AG (CH) 2022-06-30 WO disclosed
WO-2022137085-A1 INDOLE DERIVATIVES USEFUL IN TREATING CONDITIONS ASSOCIATED WITH CGAS NOVARTIS AG (CH) 2022-06-30 WO disclosed