SCHEMBL28890241

SCHEMBL28890241

CC(CCC(=O)c1ccc(F)c(Cl)c1)OC(N)=O

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.39
TSHR P16473 2/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
DPP4 P27487 1/20 0.37
MAPT P10636 1/20 0.37
CASP3 P42574 1/20 0.37
SENP7 Q9BQF6 1/20 0.37
LMNA P02545 1/20 0.37
TAS1R3 Q7RTX0 1/20 0.36
TAS1R1 Q7RTX1 1/20 0.36
TAS1R2 Q8TE23 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
SCHEMBL28401226 0.88 DPP4 (0.47) SMN1; SMN2TSHRMEN1KMT2ADPP4
SCHEMBL28401228 0.88 DPP4 (0.47) SMN1; SMN2TSHRMEN1KMT2ADPP4
SCHEMBL23891810 0.82 SMN1; SMN2 (0.43) SMN1; SMN2TSHRKDM4EDPP4LMNA
SCHEMBL23878366 0.82 HTT (0.43) SMN1; SMN2TSHRKDM4EMEN1KMT2A
SCHEMBL28407065 0.81 NPC1 (0.50) SMN1; SMN2TSHRKDM4EMEN1KMT2A
SCHEMBL28398674 0.80 CES2 (0.38) TSHRDPP4MAPTLMNATAS1R3
SCHEMBL28398673 0.80 CES2 (0.38) TSHRDPP4MAPTLMNATAS1R3
SCHEMBL7436605 0.74 HPGD (0.52) SMN1; SMN2TSHRKDM4EMEN1KMT2A
SCHEMBL28407079 0.74 ACKR3 (0.44)
SCHEMBL28407080 0.74 ACKR3 (0.44)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111217802-B Histone acetylase p300 inhibitor and application thereof 海创药业股份有限公司 2021-10-08 CN disclosed
CN-111217802-A Histone acetylase p300 inhibitor and application thereof 成都海创药业有限公司 2020-06-02 CN disclosed