SCHEMBL28690641

SCHEMBL28690641

O=C(Cc1ccccc1C(F)(F)F)Nc1ccc(=O)n(-c2ccccc2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR2E1 Q9Y466 2/20 0.51
KCNJ5 P48544 2/20 0.47
KCNJ3 P48549 2/20 0.47
CSF1R P07333 1/20 0.46
PDGFRB P09619 1/20 0.46
KIT P10721 1/20 0.46
PDGFRA P16234 1/20 0.46
FLT3 P36888 1/20 0.46
ANO1 Q5XXA6 2/20 0.45
SIGMAR1 Q99720 1/20 0.43
P2RX4 Q99571 2/20 0.42
NTRK1 P04629 1/20 0.41
POLQ O75417 1/20 0.41
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40
PSMB5 P28074 1/20 0.40
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40
GAA P10253 1/20 0.39

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
SCHEMBL28697076 0.84 ELOVL1 (0.52) KCNJ5KCNJ3ANO1MEN1KMT2A
SCHEMBL28700602 0.82 NLRP3 (0.53) NR2E1KCNJ5KCNJ3SIGMAR1MEN1
SCHEMBL28708127 0.82 CA12 (0.53) KCNJ5KCNJ3ANO1SIGMAR1MEN1
SCHEMBL28684562 0.82 KCNJ5 (0.56) NR2E1KCNJ5KCNJ3P2RX4
SCHEMBL28690666 0.82 TDP1 (0.52) ANO1MEN1MAPTKMT2ACYP1A2
SCHEMBL28706294 0.80 KMT2A (0.58) MEN1MAPTKMT2A
SCHEMBL28706314 0.80 KCNK3 (0.53) MEN1KMT2AGAA
SCHEMBL28933287 0.80 MEN1 (0.68) NR2E1SIGMAR1MEN1MAPTKMT2A
SCHEMBL29389113 0.80 MEN1 (0.68) NR2E1SIGMAR1MEN1MAPTKMT2A
SCHEMBL28704823 0.79 MEN1 (0.57) MEN1MAPTKMT2AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114057630-B Pirfenidone derivative and synthetic method and application thereof 郑州大学 2023-06-02 CN claimed
CN-114057630-A Pirfenidone derivative and synthetic method and application thereof 郑州大学 2022-02-18 CN claimed
CN-114057630-B Pirfenidone derivative and synthetic method and application thereof 郑州大学 2023-06-02 CN disclosed
CN-114057630-A Pirfenidone derivative and synthetic method and application thereof 郑州大学 2022-02-18 CN disclosed