SCHEMBL30720002

SCHEMBL30720002

Cc1c(C(=O)O)[nH]c2ncc(C(F)(F)F)cc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AGBL2 Q5U5Z8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.40
MAPK1 P28482 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 5/20 0.37
POLB P06746 2/20 0.37
KDM4E B2RXH2 2/20 0.37
PKM P14618 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C19 P33261 1/20 0.37
GPR35 Q9HC97 1/20 0.36
GAA P10253 2/20 0.36
NOTUM Q6P988 1/20 0.36
LMNA P02545 1/20 0.36
DHODH Q02127 1/20 0.36
SORT1 Q99523 1/20 0.36

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
SCHEMBL29153656 1.00 AGBL2 (0.46) AGBL2L3MBTL1MAPK1SMN1; SMN2KMT2A
SCHEMBL30104818 0.84 L3MBTL1 (0.48) L3MBTL1KMT2AMEN1ALDH1A1POLB
SCHEMBL29153676 0.84 L3MBTL1 (0.48) L3MBTL1KMT2AMEN1ALDH1A1POLB
SCHEMBL29153634 0.83 PRNP (0.42) AGBL2L3MBTL1MAPK1SMN1; SMN2KMT2A
SCHEMBL30720012 0.83 PRNP (0.42) AGBL2L3MBTL1MAPK1SMN1; SMN2KMT2A
SCHEMBL8325679 0.80 EGFR (0.40) AGBL2L3MBTL1MAPK1SMN1; SMN2KMT2A
SCHEMBL29153677 0.74 L3MBTL1 (0.44) AGBL2L3MBTL1SMN1; SMN2KMT2AMEN1
SCHEMBL30720005 0.74 L3MBTL1 (0.44) AGBL2L3MBTL1SMN1; SMN2KMT2AMEN1
SCHEMBL4616764 0.73 KMT2A (0.64) MAPK1KMT2AMEN1ALDH1A1POLB
SCHEMBL18366537 0.72 MAPK1 (0.40) AGBL2MAPK1SMN1; SMN2ALDH1A1KDM4E

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
CN-117396485-A PARP7 inhibitors 轩竹生物科技股份有限公司 2024-01-12 CN disclosed