SCHEMBL31370880

SCHEMBL31370880

CCCCCCCC/C=C\CCCCCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)OC

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.67
FAAH O00519 2/20 0.60
HDAC1 Q13547 6/20 0.58
HDAC6 Q9UBN7 6/20 0.58
PSMB11 A5LHX3 1/20 0.57
PSMA7 O14818 1/20 0.57
PSMB1 P20618 1/20 0.57
PSMA1 P25786 1/20 0.57
PSMA2 P25787 1/20 0.57
PSMA3 P25788 1/20 0.57
PSMA4 P25789 1/20 0.57
PSMB8 P28062 1/20 0.57
PSMB9 P28065 1/20 0.57
PSMA5 P28066 1/20 0.57
PSMB4 P28070 1/20 0.57
PSMB6 P28072 1/20 0.57
PSMB5 P28074 1/20 0.57
PSMB10 P40306 1/20 0.57
PSMB3 P49720 1/20 0.57
PSMB2 P49721 1/20 0.57

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
SCHEMBL26114055 1.00 CNR1 (0.67) CNR1FAAHHDAC1HDAC6PSMB11
SCHEMBL7217563 0.94 CNR1 (0.66) CNR1FAAHHDAC1HDAC6PSMB11
SCHEMBL7217568 0.94 CNR1 (0.66) CNR1FAAHHDAC1HDAC6PSMB11
SCHEMBL14472130 0.93 HDAC1 (0.66) HDAC1HDAC6GRIA1
SCHEMBL2337076 0.93 HDAC1 (0.66) HDAC1HDAC6GRIA1
SCHEMBL14472192 0.93 HDAC1 (0.66) HDAC1HDAC6GRIA1
SCHEMBL18220518 0.93 HDAC1 (0.66) HDAC1HDAC6GRIA1
SCHEMBL27910970 0.93 HDAC1 (0.66) HDAC1HDAC6GRIA1
SCHEMBL42986 0.92 HDAC1 (0.64) CNR1HDAC1HDAC6GRIA1CNR2
SCHEMBL43741 0.92 HDAC1 (0.64) CNR1HDAC1HDAC6GRIA1CNR2

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-119677506-A Small molecule allosteric modulators of serotonin (5-HT) 5-HT2C and 5-HT2A receptors 得克萨斯系统大学董事会 2025-03-21 CN disclosed