SCHEMBL28985920

SCHEMBL28985920

O=C(O)c1ccc(N=Cc2c3ccccc3cc3ccccc23)cc1C(=O)O

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 10/20 0.51
▸ MEN1 O00255 6/20 0.51
▸ HKDC1 Q2TB90 1/20 0.51
▸ GAA P10253 2/20 0.50
▸ POLB P06746 5/20 0.48
▸ LMNA P02545 2/20 0.48
▸ MAPT P10636 5/20 0.47
▸ HTT P42858 2/20 0.47
▸ PLEC Q15149 1/20 0.47
▸ ALDH1A1 P00352 3/20 0.45
▸ LDHA P00338 1/20 0.44
▸ KDM4E B2RXH2 2/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ GLA P06280 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ CYP2D6 P10635 1/20 0.43
▸ THRB P10828 1/20 0.43
▸ BLM P54132 1/20 0.43

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
SCHEMBL678244 0.89 KMT2A (0.55) KMT2AMEN1HKDC1GAAPOLB
SCHEMBL678243 0.89 KMT2A (0.55) KMT2AMEN1HKDC1GAAPOLB
SCHEMBL28985919 0.79 KMT2A (0.57) KMT2AMEN1HKDC1GAAPOLB
SCHEMBL4912911 0.79 KMT2A (0.57) KMT2AMEN1HKDC1GAAPOLB
SCHEMBL4912916 0.79 KMT2A (0.57) KMT2AMEN1HKDC1GAAPOLB
SCHEMBL12416949 0.71 CA2 (0.62) ALDH1A1
SCHEMBL3917470 0.70 KMT2A (0.67) KMT2AMEN1HKDC1GAAPOLB
SCHEMBL3917467 0.70 KMT2A (0.67) KMT2AMEN1HKDC1GAAPOLB
SCHEMBL28132475 0.69 NR4A1 (0.52) KMT2AMEN1POLBLMNAALDH1A1
SCHEMBL18082964 0.69 ACHE (0.67) KMT2AMEN1HKDC1GAAPOLB

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-115957818-A Synthesis of two-dimensional layered Sm-MOF and separation and catalysis of compound of Sm-MOF on water pollutants 聊城大学 2023-04-14 — — CN claimed
CN-115957818-A Synthesis of two-dimensional layered Sm-MOF and separation and catalysis of compound of Sm-MOF on water pollutants 聊城大学 2023-04-14 — — CN disclosed
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