SCHEMBL28875591

SCHEMBL28875591

CCC1(C)NC(=O)N(Cl)C1=O

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 3/20 0.41
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
ALDH1A1 P00352 2/20 0.35
POLB P06746 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
KDM4E B2RXH2 2/20 0.32
ESR1 P03372 1/20 0.32
MAPT P10636 1/20 0.32
ESR2 Q92731 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CYP2C19 P33261 4/20 0.31
LMNA P02545 1/20 0.31
MGAT1 P26572 1/20 0.31
MGAT2 Q10469 1/20 0.31
TSHR P16473 1/20 0.30

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
SCHEMBL15026088 0.76 CYP2C19 (0.46) FPR2NPC1RAB9AALDH1A1POLB
SCHEMBL22919778 0.74 FPR2 (0.39) FPR2NPC1RAB9AALDH1A1POLB
SCHEMBL19853470 0.74 FPR2 (0.47) FPR2NPC1RAB9AALDH1A1POLB
SCHEMBL11061919 0.74 FPR2 (0.42) FPR2NPC1RAB9AALDH1A1POLB
SCHEMBL20614629 0.74 FPR2 (0.47) FPR2NPC1RAB9AALDH1A1POLB
SCHEMBL26348543 0.74 FPR2 (0.39) FPR2NPC1RAB9AALDH1A1POLB
SCHEMBL11750459 0.72 FPR2 (0.43) FPR2NPC1RAB9AALDH1A1POLB
SCHEMBL2262662 0.72 POLB (0.50) ALDH1A1POLBKDM4ELMNATSHR
SCHEMBL16200785 0.71 FPR2 (0.37) FPR2NPC1RAB9AALDH1A1POLB
SCHEMBL3390294 0.71 NPC1 (0.40) FPR2NPC1RAB9AALDH1A1POLB

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
CN-110150289-A A kind of Treatment of Industrial Water antimildew and antibacterial liquid and preparation method thereof 河北利仕化学科技有限公司 2019-08-23 CN disclosed