SCHEMBL31348895

SCHEMBL31348895

CCCC(=O)C1CC(=O)NC(=O)C1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.48
CRBN Q96SW2 1/20 0.41
LMNA P02545 2/20 0.38
PRKCA P17252 1/20 0.35
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
CYP2C19 P33261 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
NR2F2 P24468 1/20 0.33
CES2 O00748 1/20 0.32
CES1 P23141 1/20 0.32
NPC1 O15118 1/20 0.32
BRD4 O60885 1/20 0.32
CREBBP Q92793 1/20 0.32
POLB P06746 1/20 0.32
MAPT P10636 1/20 0.32
TSHR P16473 1/20 0.32
CHRNB2 P17787 1/20 0.32
CHRNA3 P32297 1/20 0.32
CHRNA4 P43681 1/20 0.32

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
SCHEMBL8178098 0.77 HSD17B10 (0.55) HSD17B10CRBNLMNAALDH1A1L3MBTL1
SCHEMBL12435982 0.72 CRBN (0.50) CRBNLMNAALDH1A1CYP2C19L3MBTL1
SCHEMBL4712321 0.71
SCHEMBL27878299 0.71 MTNR1A (0.50) KDM4EALDH1A1CES2CES1NPC1
SCHEMBL8176560 0.70 HSD17B10 (0.46) HSD17B10CRBNLMNAALDH1A1NPC1
SCHEMBL935406 0.69 CRBN (0.46) CRBNKDM4EALDH1A1CYP2C19L3MBTL1
SCHEMBL23728065 0.67 CRBN (0.44) CRBNALDH1A1L3MBTL1NR2F2ITGB3
SCHEMBL935426 0.67 KMT2A (0.50) CRBNKDM4EALDH1A1L3MBTL1BRD4
SCHEMBL2127808 0.67 CES2 (0.42) HSD17B10ALDH1A1CES2CES1TSHR
SCHEMBL8156241 0.67

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-2025051102-A1 DEUTERATED TETRACYCLIC DERIVATIVE AND USE THEREOF 浙江我武翼方药业有限公司 2025-03-13 WO disclosed
CN-119591611-A Deuterated tetracyclic derivative and application thereof 浙江我武翼方药业有限公司 2025-03-11 CN disclosed