SCHEMBL11060131

SCHEMBL11060131

CN(C)c1ccc(C(=O)C=CC(=O)O)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.65
RAB9A P51151 7/20 0.65
NPC1 O15118 6/20 0.65
KMT2A Q03164 4/20 0.65
SMN1; SMN2 Q16637 4/20 0.65
CASP3 P42574 1/20 0.65
CYP1B1 Q16678 1/20 0.65
SENP8 Q96LD8 1/20 0.65
SENP7 Q9BQF6 1/20 0.65
SENP6 Q9GZR1 1/20 0.65
ALDH1A1 P00352 5/20 0.63
HPGD P15428 4/20 0.63
THRB P10828 2/20 0.63
NPSR1 Q6W5P4 2/20 0.63
LMNA P02545 2/20 0.63
HTT P42858 1/20 0.63
CRHBP P24387 1/20 0.58
CRHR2 Q13324 1/20 0.58
TLR9 Q9NR96 1/20 0.58
NR4A1 P22736 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
SCHEMBL10783931 1.00 MAPT (0.65) MAPTRAB9ANPC1KMT2ASMN1; SMN2
SCHEMBL14745637 0.81 MAPT (0.68) MAPTRAB9ANPC1KMT2ASMN1; SMN2
SCHEMBL14745638 0.81 MAPT (0.68) MAPTRAB9ANPC1KMT2ASMN1; SMN2
Maleic Acid SCHEMBL28501255 0.79 NR4A1 (0.59) MAPTRAB9ANPC1KMT2ASMN1; SMN2
SCHEMBL2911444 0.79 TLR9 (0.87) MAPTRAB9ANPC1KMT2ASMN1; SMN2
SCHEMBL2911445 0.79 TLR9 (0.87) MAPTRAB9ANPC1KMT2ASMN1; SMN2
SCHEMBL482915 0.79 MAPT (1.00) MAPTRAB9ANPC1KMT2ASMN1; SMN2
SCHEMBL482916 0.79 MAPT (1.00) MAPTRAB9ANPC1KMT2ASMN1; SMN2
SCHEMBL6263294 0.78 MAPT (0.57) MAPTRAB9ANPC1KMT2ASMN1; SMN2
SCHEMBL3046452 0.78 MAPT (0.61) MAPTRAB9ANPC1KMT2ASMN1; SMN2

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
US-4486429-A ANTICIDS ROUSSEL UCLAF (FR) 1984-12-04 US claimed
US-4486429-A ANTICIDS ROUSSEL UCLAF (FR) 1984-12-04 US disclosed