SCHEMBL29137661

SCHEMBL29137661

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nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.60
▸ KMT2A Q03164 5/20 0.60
▸ CYP2C19 P33261 2/20 0.60
▸ RECQL P46063 1/20 0.60
▸ CYP1A2 P05177 4/20 0.55
▸ LMNA P02545 4/20 0.55
▸ HRH1 P35367 1/20 0.55
▸ SMN1; SMN2 Q16637 1/20 0.55
▸ MAPK1 P28482 4/20 0.54
▸ MAPT P10636 4/20 0.54
▸ GMNN O75496 3/20 0.54
▸ NPSR1 Q6W5P4 3/20 0.54
▸ TP53 P04637 3/20 0.54
▸ TSHR P16473 3/20 0.54
▸ HSP90AA1 P07900 2/20 0.54
▸ BLM P54132 2/20 0.54
▸ NR1H4 Q96RI1 2/20 0.54
▸ CYP2C9 P11712 2/20 0.54
▸ HIF1A Q16665 2/20 0.54
▸ SLC25A20 O43772 3/20 0.52

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
SCHEMBL21631711 1.00 MEN1 (0.60) MEN1KMT2ACYP2C19RECQLCYP1A2
SCHEMBL19655965 0.94 MEN1 (0.65) MEN1KMT2ACYP2C19RECQLCYP1A2
SCHEMBL21594797 0.94 MEN1 (0.65) MEN1KMT2ACYP2C19RECQLCYP1A2
SCHEMBL28290850 0.91 LMNA (0.62) MEN1KMT2ACYP2C19RECQLCYP1A2
SCHEMBL16238330 0.91 MEN1 (0.73) MEN1KMT2ACYP2C19RECQLCYP1A2
SCHEMBL232380 0.84 MEN1 (0.69) MEN1KMT2ACYP2C19RECQLCYP1A2
SCHEMBL16915065 0.83 LMNA (0.57) MEN1KMT2ACYP2C19RECQLCYP1A2
SCHEMBL19651149 0.83 LMNA (0.57) MEN1KMT2ACYP2C19RECQLCYP1A2
SCHEMBL12137165 0.82 LMNA (0.64) MEN1KMT2ACYP2C19RECQLCYP1A2
SCHEMBL28369482 0.82 CYP1A2 (0.62) MEN1KMT2ACYP2C19RECQLCYP1A2

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-109563127-B Compounds, agents and uses thereof 麦特博隆股份有限公司 2024-01-05 — — CN claimed
CN-109563127-B Compounds, agents and uses thereof 麦特博隆股份有限公司 2024-01-05 — — CN disclosed
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