SCHEMBL28996929

SCHEMBL28996929

C=CC(=O)Nc1ccc2c(c1)C(Nc1ccc(F)cc1)CC2

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 7/20 0.54
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
DDB1 Q16531 1/20 0.40
CRBN Q96SW2 1/20 0.40
TRPV1 Q8NER1 3/20 0.40
EGFR P00533 2/20 0.40
ITK Q08881 1/20 0.40
TP53 P04637 1/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
JAK3 P52333 1/20 0.38
F13A1 P00488 3/20 0.38
TGM1 P22735 3/20 0.38
LMNA P02545 1/20 0.38
TGM3 Q08188 1/20 0.38

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
SCHEMBL28996991 0.92 TGM2 (0.46) TGM2NPC1RAB9ATRPV1EGFR
SCHEMBL28996930 0.91 TGM2 (0.54) TGM2HDAC8HDAC6NPC1RAB9A
SCHEMBL28996932 0.91 TGM2 (0.54) TGM2HDAC8HDAC6NPC1RAB9A
SCHEMBL29370301 0.91 TGM2 (0.54) TGM2HDAC8HDAC6NPC1RAB9A
SCHEMBL28996928 0.91 TGM2 (0.54) TGM2HDAC8HDAC6NPC1RAB9A
SCHEMBL25411746 0.89 KMT2A (0.47) TGM2NPC1RAB9ATRPV1EGFR
SCHEMBL29370548 0.89 KMT2A (0.47) TGM2NPC1RAB9ATRPV1EGFR
SCHEMBL29369857 0.88 TGM2 (0.42) TGM2NPC1RAB9AEGFRITK
SCHEMBL26123112 0.88 TGM2 (0.42) TGM2NPC1RAB9AEGFRITK
SCHEMBL25413281 0.87 TGM2 (0.56) TGM2TRPV1EGFR

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-116057042-A Acrylamide-substituted indane compounds and their therapeutic uses 赛诺菲 2023-05-02 CN claimed
CN-116057042-B Acrylamide-substituted indane compounds and their therapeutic uses 赛诺菲 2024-10-18 CN disclosed
CN-116057042-A Acrylamide-substituted indane compounds and their therapeutic uses 赛诺菲 2023-05-02 CN disclosed