SCHEMBL30220348

SCHEMBL30220348

C[C@H](O)[C@@H]1C(=O)N[C@H](C)C(=O)N1Cc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
CYP3A4 P08684 3/20 0.42
CYP2C19 P33261 3/20 0.42
CYP1A2 P05177 2/20 0.42
CYP2C9 P11712 2/20 0.42
EHMT2 Q96KQ7 1/20 0.42
GAA P10253 2/20 0.40
HTT P42858 1/20 0.40
PAX8 Q06710 1/20 0.40
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
SMO Q99835 2/20 0.39
MMP1 P03956 1/20 0.38
MMP3 P08254 1/20 0.38
MMP9 P14780 1/20 0.38
HDAC1 Q13547 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37

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
SCHEMBL4187223 0.80 EHMT2 (0.49) ALDH1A1CYP3A4CYP2C19CYP1A2CYP2C9
SCHEMBL102314 0.80 EHMT2 (0.49) ALDH1A1CYP3A4CYP2C19CYP1A2CYP2C9
SCHEMBL4597179 0.80 EHMT2 (0.49) ALDH1A1CYP3A4CYP2C19CYP1A2CYP2C9
SCHEMBL21563321 0.78 MMP1 (0.47) ALDH1A1CYP3A4CYP2C19CYP1A2CYP2C9
SCHEMBL21563325 0.78 MMP1 (0.47) ALDH1A1CYP3A4CYP2C19CYP1A2CYP2C9
SCHEMBL21563557 0.78 MMP1 (0.47) ALDH1A1CYP3A4CYP2C19CYP1A2CYP2C9
SCHEMBL23040245 0.76 MMP1 (0.48) ALDH1A1CYP3A4CYP2C19CYP1A2CYP2C9
SCHEMBL31173351 0.76 EHMT2 (0.45) ALDH1A1EHMT2HTTTDP1MEN1
SCHEMBL29270893 0.76 MMP1 (0.48) ALDH1A1CYP3A4CYP2C19CYP1A2CYP2C9
SCHEMBL29270894 0.76 MMP1 (0.48) ALDH1A1CYP3A4CYP2C19CYP1A2CYP2C9

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-4592295-A1 PYRIMIDINE-FUSED RING COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF Genfleet Therapeutics (Shanghai) Inc. (CN) 2025-07-30 EP disclosed
WO-2023030385-A1 PYRIMIDINE-FUSED CYCLIC COMPOUND AND PREPARATION METHOD AND USE THEREOF 劲方医药科技(上海)有限公司 2023-03-09 WO disclosed