SCHEMBL24521599

SCHEMBL24521599

CCCC(=O)NCc1ccccc1C(F)(F)F

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.59
KMT2A Q03164 1/20 0.59
ALDH1A1 P00352 1/20 0.59
TAOK1 Q7L7X3 1/20 0.56
TAOK3 Q9H2K8 1/20 0.56
EPHX2 P34913 11/20 0.53
PPARG P37231 8/20 0.53
P2RX7 Q99572 1/20 0.53
HTT P42858 1/20 0.51
CYP3A4 P08684 1/20 0.50
CYP2C19 P33261 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
F2R P25116 1/20 0.49

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
SCHEMBL13059390 0.88 TAOK1 (0.58) MEN1KMT2ATAOK1TAOK3EPHX2
Hydrochloric Acid SCHEMBL17687150 0.86 TAOK1 (0.57) MEN1KMT2ATAOK1TAOK3EPHX2
SCHEMBL27858969 0.85 EPHX2 (0.62) MEN1KMT2ATAOK1TAOK3EPHX2
SCHEMBL23135875 0.84 TAOK1 (0.53) MEN1KMT2AALDH1A1TAOK1TAOK3
SCHEMBL17687021 0.84 KMT2A (0.56) MEN1KMT2AALDH1A1TAOK1TAOK3
SCHEMBL16269072 0.83 KMT2A (0.58) MEN1KMT2ATAOK1TAOK3EPHX2
SCHEMBL18438726 0.82 MEN1 (0.57) MEN1KMT2AALDH1A1TAOK1TAOK3
SCHEMBL16269091 0.82 MEN1 (0.60) MEN1KMT2ATAOK1TAOK3EPHX2
SCHEMBL7505420 0.81 ALDH1A1 (0.74) MEN1KMT2AALDH1A1CYP3A4CYP2C19
SCHEMBL3911493 0.81 EPHX2 (0.55) MEN1KMT2ATAOK1TAOK3EPHX2

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
EP-4015501-A1 N-BENZYL-ALPHA-AMINOAMIDES AS ANAPHASE-PROMOTING COMPLEX/CYCLOSOME (APC/C) INHIBITORS Consejo Superior de Investigaciones Científicas (CSIC) (ES) 2022-06-22 EP disclosed
CN-107108467-A cell necrosis inhibitor 北京生命科学研究所 2017-08-29 CN disclosed