SCHEMBL25920488

SCHEMBL25920488

C=C(NCc1ccc(Cl)cc1)/C(C)=C/C

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.50
KMT2A Q03164 5/20 0.50
CYP2C19 P33261 2/20 0.47
CYP2C9 P11712 1/20 0.47
ALDH1A1 P00352 6/20 0.44
HPGD P15428 5/20 0.44
RAB9A P51151 3/20 0.44
NPC1 O15118 2/20 0.44
MAPT P10636 3/20 0.43
THRB P10828 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
CYP1A2 P05177 1/20 0.42
TP53 P04637 1/20 0.41
ALOX12 P18054 2/20 0.41

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
SCHEMBL20432018 0.84 CYP2C19 (0.56) MEN1KMT2ACYP2C19CYP2C9ALDH1A1
SCHEMBL202718 0.74 MEN1 (0.61) MEN1KMT2ACYP2C19CYP2C9ALDH1A1
SCHEMBL20825142 0.73 MEN1 (0.55) MEN1KMT2ACYP2C19CYP2C9ALDH1A1
SCHEMBL14355138 0.72 MEN1 (0.59) MEN1KMT2ACYP2C19CYP2C9ALDH1A1
SCHEMBL196487 0.72 KMT2A (0.70) MEN1KMT2ACYP2C19CYP2C9ALDH1A1
SCHEMBL20860932 0.71 LMNA (0.41) MEN1KMT2AALDH1A1HPGDRAB9A
SCHEMBL9921513 0.70 MEN1 (0.41) MEN1KMT2ACYP2C19CYP2C9ALDH1A1
SCHEMBL18833760 0.70 MEN1 (0.51) MEN1KMT2ACYP2C19CYP2C9ALDH1A1
SCHEMBL24242175 0.69 MEN1 (0.50) MEN1KMT2ACYP2C19CYP2C9ALDH1A1
SCHEMBL10157129 0.69 MEN1 (0.59) MEN1KMT2ACYP2C19CYP2C9ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4219501-A1 COMPOUND CONTAINING 2,4-THIAZOLE RING, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF Shandong University (CN) 2023-08-02 EP disclosed