SCHEMBL7433758

SCHEMBL7433758

Cc1cccc(C(C(N)=O)N2CCC(NCC(O)C3COc4ccccc4O3)CC2)c1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.38
RAB9A P51151 1/20 0.38
LMNA P02545 2/20 0.38
MAPT P10636 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
LTA4H P09960 7/20 0.35
ALDH1A1 P00352 3/20 0.35
TSHR P16473 2/20 0.35
ADRB2 P07550 1/20 0.35
ADRB1 P08588 1/20 0.35
ADRB3 P13945 1/20 0.35
ADRA1D P25100 1/20 0.35
ADRA1A P35348 1/20 0.35
ADRA1B P35368 1/20 0.35
MAPK1 P28482 1/20 0.34
KDM4E B2RXH2 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL7436565 0.91 ALDH1A1 (0.39) LMNAMAPTSMN1; SMN2NPSR1LTA4H
SCHEMBL7443120 0.91 LMNA (0.41) NPC1RAB9ALMNAMAPTSMN1; SMN2
SCHEMBL7439458 0.90 MAPT (0.40) LMNAMAPTSMN1; SMN2NPSR1LTA4H
SCHEMBL7446573 0.90 AIMP2 (0.38) NPC1LMNAMAPTSMN1; SMN2NPSR1
SCHEMBL7442146 0.88 EPHX1 (0.41) LMNAMAPTSMN1; SMN2NPSR1LTA4H
SCHEMBL7441214 0.88 GAA (0.41) NPC1RAB9ALMNAMAPTSMN1; SMN2
SCHEMBL7435447 0.87 LMNA (0.38) NPC1RAB9ALMNAMAPTSMN1; SMN2
SCHEMBL7436658 0.87 LMNA (0.39) LMNAMAPTSMN1; SMN2NPSR1LTA4H
Hydrochloric Acid SCHEMBL7444380 0.86 LMNA (0.39) LMNAMAPTSMN1; SMN2NPSR1LTA4H
SCHEMBL7429333 0.86 MAPT (0.37) NPC1LMNAMAPTSMN1; SMN2NPSR1

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
US-4499100-A CARDIOUVASCULAR DISORDERS SYNTEX (U.S.A.) INC. (US) 1985-02-12 US disclosed