SCHEMBL28353031

SCHEMBL28353031

C=C(C)C(=O)N(C)c1ccc(Br)cc1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MAPT P10636 4/20 0.38
KDM4E B2RXH2 1/20 0.37
HPGD P15428 1/20 0.37
IDO1 P14902 1/20 0.37
LMNA P02545 3/20 0.37
RAB9A P51151 2/20 0.37
RECQL P46063 1/20 0.37
CYP1A2 P05177 1/20 0.36
CES2 O00748 1/20 0.35
CES1 P23141 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
GPBAR1 Q8TDU6 1/20 0.35
POLB P06746 1/20 0.35
STAT3 P40763 1/20 0.34

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
SCHEMBL15442018 0.84 ALDH1A1 (0.48) ALDH1A1MAPTKDM4EHPGDRAB9A
SCHEMBL4889215 0.82 APP (0.38) ALDH1A1L3MBTL1MAPTKDM4EHPGD
SCHEMBL24106352 0.82 ALDH1A1 (0.50) ALDH1A1MAPTKDM4ELMNARAB9A
SCHEMBL11744074 0.81 ALDH1A1 (0.43) ALDH1A1L3MBTL1MAPTKDM4EHPGD
SCHEMBL28250891 0.81 MAPT (0.40) MAPTKDM4ERAB9ACYP1A2CES2
SCHEMBL28356737 0.81 APP (0.38) ALDH1A1MAPTRAB9ASMN1; SMN2GPBAR1
SCHEMBL194085 0.80 HTT (0.46) L3MBTL1KDM4ELMNARAB9ASMN1; SMN2
SCHEMBL969001 0.79 SMN1; SMN2 (0.52) ALDH1A1L3MBTL1MAPTLMNARAB9A
SCHEMBL15442197 0.78 ALDH1A1 (0.47) ALDH1A1L3MBTL1MAPTKDM4EHPGD
SCHEMBL28250869 0.78 NR1H4 (0.47) ALDH1A1LMNARAB9ACYP1A2SMN1; SMN2

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
EP-4553077-A1 SULFOXIMINE COMPOUND HAVING FGFR INHIBITORY EFFECT, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND USE THEREOF Kinoteck Therapeutics Co., Ltd (CN) 2025-05-14 EP disclosed
CN-118255706-A Synthesis method of oxindole compound 浙江工业大学 2024-06-28 CN disclosed
CN-106749214-B Compound containing 1, 3-benzoxazole difluoromethylene indolone and preparation method thereof 上海大学 2020-01-17 CN disclosed