SCHEMBL28628441

SCHEMBL28628441

Cc1c(C)c(C)c(N2CCCCC2)c(C(N)=O)c1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.39
EPHX2 P34913 1/20 0.37
ALDH1A1 P00352 7/20 0.36
HTT P42858 1/20 0.36
MEN1 O00255 4/20 0.33
KMT2A Q03164 4/20 0.33
POLB P06746 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
THRB P10828 1/20 0.33
ALOX15 P16050 1/20 0.33
GFER P55789 1/20 0.33
YWHAG P61981 1/20 0.33
HSD17B10 Q99714 1/20 0.33
IKBKB O14920 1/20 0.33
HPGD P15428 3/20 0.33
NPSR1 Q6W5P4 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33

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
SCHEMBL29274947 0.79 ALDH1A1 (0.43) NPC1ALDH1A1HTTMEN1KMT2A
SCHEMBL9544174 0.75 ALDH1A1 (0.47) NPC1ALDH1A1HTTMEN1KMT2A
SCHEMBL15078018 0.75 EPHX2 (0.39) EPHX2ALDH1A1HTTMEN1KMT2A
Bromide SCHEMBL9763941 0.74 ALDH1A1 (0.46) NPC1ALDH1A1HTTMEN1KMT2A
SCHEMBL30843869 0.73 EPHX2 (0.36) NPC1EPHX2ALDH1A1MEN1KMT2A
SCHEMBL17675109 0.70 ALDH1A1 (0.40) ALDH1A1HTTMEN1KMT2AKDM4E
SCHEMBL17675112 0.70 SCN10A (0.40) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL2221293 0.70 POLB (0.52) NPC1ALDH1A1MEN1KMT2APOLB
SCHEMBL1003996 0.70 POLB (0.52) NPC1ALDH1A1MEN1KMT2APOLB
SCHEMBL27840443 0.69 POLB (0.35) ALDH1A1POLBPKM

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118994402-A Antibodies to PMEL17 and conjugates thereof 诺华股份有限公司 2024-11-22 CN disclosed
CN-118955718-A Antibody drug conjugates and methods of making the same 诺华股份有限公司 2024-11-15 CN disclosed
CN-113195541-B Antibodies to PMEL17 and conjugates thereof 诺华股份有限公司 2024-08-30 CN disclosed
CN-118420766-A Antibodies to PMEL17 and conjugates thereof 诺华股份有限公司 2024-08-02 CN disclosed
CN-113195541-A Antibodies against PMEL17 and conjugates thereof 诺华股份有限公司 2021-07-30 CN disclosed