SCHEMBL28530965

SCHEMBL28530965

NC(=O)Oc1cccc(C[C@@H](O)c2nccs2)c1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
CTSA P10619 13/20 0.44
ALOX5 P09917 1/20 0.42
NR3C2 P08235 1/20 0.38
FFAR1 O14842 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
MAPK8 P45983 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
SCHEMBL28530968 1.00 MEN1 (0.46) MEN1KMT2ACTSAALOX5NR3C2
SCHEMBL28523142 0.89 MEN1 (0.45) MEN1KMT2ACTSAALOX5FFAR1
SCHEMBL28523145 0.89 MEN1 (0.45) MEN1KMT2ACTSAALOX5FFAR1
SCHEMBL28519067 0.82 CTSA (0.41) MEN1KMT2ACTSAALOX5FFAR1
SCHEMBL28519070 0.82 CTSA (0.41) MEN1KMT2ACTSAALOX5FFAR1
SCHEMBL28524919 0.82 CTSA (0.40) CTSAALOX5FFAR1NPC1RAB9A
SCHEMBL21598766 0.79 ADRB2 (0.40) CTSAALOX5
SCHEMBL21598765 0.79 ADRB2 (0.40) CTSAALOX5
SCHEMBL9434609 0.77 ALOX5 (0.43) CTSAALOX5
SCHEMBL21598768 0.75 MAPT (0.43) MEN1KMT2ACTSANPC1RAB9A

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-116615252-A anti-CD 48 antibodies, antibody drug conjugates and uses thereof 诺华股份有限公司 2023-08-18 CN disclosed
CN-112437675-A Antibody drug conjugates for ablating hematopoietic stem cells 诺华股份有限公司 2021-03-02 CN disclosed