SCHEMBL30451534

SCHEMBL30451534

COc1ccc(Cl)cc1-c1ccc2c(=O)[nH]ncc2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.45
KDM4E B2RXH2 4/20 0.44
ALDH1A1 P00352 3/20 0.44
HPGD P15428 2/20 0.44
HSD17B10 Q99714 2/20 0.44
MAPK1 P28482 1/20 0.44
AGPAT2 O15120 4/20 0.42
ELANE P08246 1/20 0.42
USP2 O75604 1/20 0.41
PRNP P04156 1/20 0.41
PPARG P37231 1/20 0.41
MAPK10 P53779 1/20 0.41
NCOA2 Q15596 1/20 0.41
NCOA1 Q15788 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
SCN9A Q15858 3/20 0.40
ERN1 O75460 1/20 0.40
BRD4 O60885 1/20 0.40

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
SCHEMBL601322 0.78 NOS1 (0.56) ALDH1A1HSD17B10USP2NPSR1TDP1
SCHEMBL7202311 0.77 ALDH1A1 (0.40) KDM4EALDH1A1HPGDHSD17B10MAPK1
SCHEMBL30451992 0.74 ABL1 (0.46) ABL1KDM4EALDH1A1HPGDAGPAT2
SCHEMBL24252484 0.74 ABL1 (0.46) ABL1KDM4EALDH1A1HPGDAGPAT2
SCHEMBL1009542 0.71 HSD17B10 (0.51) KDM4EALDH1A1HPGDHSD17B10MAPK1
SCHEMBL30777062 0.71 FGFR1 (0.47) KDM4EALDH1A1HSD17B10TDP1
SCHEMBL27172619 0.71 FGFR1 (0.47) KDM4EALDH1A1HSD17B10TDP1
SCHEMBL3977212 0.71 ALDH1A1 (0.51) KDM4EALDH1A1HPGDHSD17B10MAPK1
SCHEMBL24252955 0.70 ABL1 (0.52) ABL1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL30451948 0.70 ABL1 (0.52) ABL1KDM4EALDH1A1HPGDHSD17B10

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
CN-116947903-A Inhibitors of complement factors and uses thereof 安尼艾克松股份有限公司 2023-10-27 CN disclosed
CN-116261564-A Inhibitors of complement factors and uses thereof 安尼艾克松股份有限公司 2023-06-13 CN disclosed