SCHEMBL9530467

SCHEMBL9530467

Clc1ccc(Cc2cc3c(OCc4ccc5ccccc5n4)cccc3[nH]2)cc1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 2/20 0.44
PDE10A Q9Y233 2/20 0.43
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CYSLTR1 Q9Y271 4/20 0.42
CYSLTR2 Q9NS75 2/20 0.42
GPBAR1 Q8TDU6 1/20 0.42
RHEB Q15382 1/20 0.42
FFAR1 O14842 1/20 0.40
AKR1B1 P15121 1/20 0.40

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
SCHEMBL9529663 0.80 PDE10A (0.51) ALOX5APPDE10ACYSLTR1CYSLTR2GPBAR1
SCHEMBL6992585 0.74 RHEB (0.53) MAPTRHEB
SCHEMBL9203751 0.73 ALOX5AP (0.49) ALOX5APPDE10ALMNAMAPTHTT
SCHEMBL9529057 0.72 PDE10A (0.48) ALOX5APPDE10ACYSLTR1CYSLTR2GPBAR1
SCHEMBL1004347 0.72 CYSLTR1 (0.61) PDE10ACYSLTR1CYSLTR2GPBAR1
SCHEMBL9210004 0.72 CYSLTR1 (0.51) PDE10ACYSLTR1CYSLTR2GPBAR1
SCHEMBL17663970 0.70 PTK2 (0.48) LMNAMAPTHTTSMN1; SMN2L3MBTL1
SCHEMBL10690965 0.69 CYSLTR1 (0.76) ALOX5APPDE10ACYSLTR1CYSLTR2GPBAR1
SCHEMBL10662425 0.69 CYSLTR1 (0.61) PDE10ACYSLTR1CYSLTR2GPBAR1
SCHEMBL8690875 0.69 LMNA (0.41) PDE10ALMNASMN1; SMN2CYSLTR1GPBAR1

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
EP-0544821-A1 INDOLE DERIVATIVES AS ANTIALLERGY AND ANTIINFLAMMATORY AGENTS. PFIZER (US) 1993-06-09 EP disclosed
WO-1992006088-A1 INDOLE DERIVATIVES AS ANTIALLERGY AND ANTIINFLAMMATORY AGENTS PFIZER INC. (US) 1992-04-16 WO disclosed