SCHEMBL28504148

SCHEMBL28504148

CCCCC(=O)Oc1cccc(C)c1N

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.57
▸ MEN1 O00255 2/20 0.57
▸ KDM4E B2RXH2 1/20 0.57
▸ RECQL P46063 1/20 0.57
▸ POLM Q9NP87 2/20 0.49
▸ POLK Q9UBT6 2/20 0.49
▸ POLL Q9UGP5 2/20 0.49
▸ POLH Q9Y253 2/20 0.49
▸ ALOX15 P16050 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ DRD2 P14416 1/20 0.40
▸ DRD1 P21728 1/20 0.40
▸ HTR2A P28223 1/20 0.40
▸ FPR1 P21462 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ MAPK1 P28482 1/20 0.39
▸ ALOX5 P09917 1/20 0.39
▸ PPARG P37231 1/20 0.39
▸ PPARA Q07869 1/20 0.39

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
SCHEMBL499472 0.85 KMT2A (0.67) KMT2AMEN1KDM4ERECQLPOLM
SCHEMBL15547116 0.84 KMT2A (0.57) KMT2AMEN1KDM4ERECQLPOLM
SCHEMBL27543235 0.84 KDM4E (0.57) KMT2AMEN1KDM4ERECQLPOLM
SCHEMBL8389447 0.84 MEN1 (0.57) KMT2AMEN1KDM4ERECQLPOLM
SCHEMBL28309434 0.83 ACHE (0.47) KMT2AMEN1KDM4ERECQLALOX15
Hydrochloric Acid SCHEMBL27537273 0.83 MEN1 (0.56) KMT2AMEN1KDM4ERECQLPOLM
Hydrochloric Acid SCHEMBL29175087 0.82 ACHE (0.46) KMT2AMEN1KDM4ERECQLALOX15
SCHEMBL16756230 0.81 KDM4E (0.75) KMT2AMEN1KDM4ERECQLPOLM
SCHEMBL8934268 0.81 KDM4E (0.60) KMT2AMEN1KDM4ERECQLPOLM
SCHEMBL27869842 0.81 KDM4E (0.65) KMT2AMEN1KDM4ERECQLPOLM

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
CN-112165940-A OX2R compound 德克萨斯州立大学董事会 2021-01-01 — — CN disclosed
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