SCHEMBL28294334

SCHEMBL28294334

CC(C)(O)CNC(=O)c1cc(OC(N)=O)ccn1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.46
CNR2 P34972 2/20 0.42
SCN9A Q15858 4/20 0.40
CFTR P13569 2/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
RAF1 P04049 2/20 0.38
TGFBR1 P36897 1/20 0.37
CHRM1 P11229 1/20 0.37
KDR P35968 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
SCHEMBL28292627 0.88 SCN9A (0.41) LOXL2SCN9AMEN1KMT2ARAF1
SCHEMBL28292621 0.82 BRAF (0.46) LOXL2MEN1KMT2ARAF1
SCHEMBL28940983 0.81 SCN9A (0.40) LOXL2SCN9ACFTRMEN1KMT2A
SCHEMBL28963812 0.81 SCN9A (0.40) LOXL2SCN9ACFTRMEN1KMT2A
SCHEMBL28292592 0.80 KDR (0.53) MEN1KMT2ARAF1KDR
SCHEMBL28292577 0.80 CCNC (0.48) CNR2SCN9ACFTR
SCHEMBL28940978 0.77 SCN9A (0.39) CNR2SCN9ACFTRCHRM1
SCHEMBL29262259 0.75 MEN1 (0.48) MEN1KMT2ARAF1KDR
SCHEMBL28292551 0.75 LNPEP (0.46) MEN1KMT2A
SCHEMBL28292634 0.75 MEN1 (0.52) MEN1KMT2ARAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109689647-B Bicyclic heteroaryl substituted compounds 百时美施贵宝公司 2023-01-20 CN claimed
CN-109689647-B Bicyclic heteroaryl substituted compounds 百时美施贵宝公司 2023-01-20 CN disclosed
CN-109689647-A The compound that bicyclic heteroaryl replaces 百时美施贵宝公司 2019-04-26 CN disclosed