SCHEMBL20686264

SCHEMBL20686264

COc1cc(-c2cc(Cl)ccc2C(C)C)c(C)cn1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
USP2 O75604 1/20 0.36
PABPC1 P11940 1/20 0.36
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HTR2A P28223 2/20 0.35
SLC6A4 P31645 2/20 0.35
KCNH2 Q12809 2/20 0.35
TGFBR1 P36897 2/20 0.34
RECQL P46063 1/20 0.34
CTSA P10619 2/20 0.34
NNMT P40261 1/20 0.33
IDO1 P14902 1/20 0.33
JAK2 O60674 1/20 0.32
ORAI1 Q96D31 1/20 0.32
PIK3CD O00329 1/20 0.32
PIK3CA P42336 1/20 0.32
PIK3CB P42338 1/20 0.32

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
SCHEMBL20686294 0.85 MEN1 (0.35) MEN1KMT2AUSP2PABPC1TSHR
SCHEMBL20686222 0.81 TGFBR1 (0.36) MEN1KMT2AUSP2PABPC1TGFBR1
SCHEMBL17633302 0.77 JAK2 (0.40) MEN1KMT2AJAK2
SCHEMBL17051052 0.77 TRPV1 (0.41) MEN1KMT2ANPSR1
SCHEMBL18557597 0.76 MEN1 (0.43) MEN1KMT2ANPSR1NNMT
SCHEMBL18327670 0.75 IDO1 (0.41) MEN1KMT2AUSP2PABPC1NPSR1
SCHEMBL16114660 0.75 RECQL (0.37) MEN1KMT2AUSP2PABPC1NPSR1
SCHEMBL20686251 0.74 LMNA (0.38) MEN1KMT2ACTSA
SCHEMBL17629783 0.74 F11 (0.38) MEN1KMT2AUSP2PABPC1NPSR1
SCHEMBL23332599 0.73 NNMT (0.43) MEN1KMT2APABPC1TSHRNNMT

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
EP-3197872-B1 (2H)-2-OXOPYRIDINES AS FAKTOR XIA-INHIBITORS FOR TREATING THROMBOTIC DISEASES Bayer Pharma AG (DE) 2019-01-30 EP disclosed