SCHEMBL10474456

SCHEMBL10474456

CCCCCC[C@@H](CC)Sc1ccc(C(=O)O)cc1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.55
TP53 P04637 1/20 0.48
TSHR P16473 1/20 0.48
RARB P10826 8/20 0.47
PLA2G4B P0C869 4/20 0.47
MEN1 O00255 1/20 0.47
ALDH1A1 P00352 1/20 0.47
RARA P10276 1/20 0.47
MAPT P10636 1/20 0.47
MTOR P42345 1/20 0.47
KMT2A Q03164 1/20 0.47
CYSLTR2 Q9NS75 1/20 0.43
CYSLTR1 Q9Y271 1/20 0.43
PLA2G4A P47712 1/20 0.43

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
SCHEMBL10474458 1.00 HTT (0.55) HTTTP53TSHRRARBPLA2G4B
SCHEMBL10474550 0.84 HTT (0.53) HTTTP53TSHRRARBPLA2G4B
SCHEMBL10474551 0.84 HTT (0.53) HTTTP53TSHRRARBPLA2G4B
SCHEMBL10475034 0.84 HTT (0.53) HTTTP53TSHRRARBPLA2G4B
SCHEMBL5968015 0.81 CSNK1E (0.41) MEN1ALDH1A1KMT2A
SCHEMBL10436359 0.81 CSNK1E (0.41) MEN1ALDH1A1KMT2A
SCHEMBL11407917 0.79 LMNA (0.41) ALDH1A1
SCHEMBL10473487 0.77 HTT (0.55) HTTTP53TSHRRARBPLA2G4B
SCHEMBL10473486 0.77 HTT (0.55) HTTTP53TSHRRARBPLA2G4B
Dodecane SCHEMBL9354416 0.77 TP53 (0.71) TP53TSHRRARBPLA2G4BMEN1

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-4943385-A DISPLAYS AND LIGHT SWITCHING ELEMENTS CHISSO CORPORATION (JP) 1990-07-24 US disclosed