SCHEMBL9528615

SCHEMBL9528615

O=C(c1ccc(Cl)cc1)c1cc2cc(OCc3ccc4ccccc4n3)ccc2[nH]1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPBAR1 Q8TDU6 3/20 0.54
PDGFRB P09619 4/20 0.53
PDGFRA P16234 4/20 0.53
CYSLTR1 Q9Y271 6/20 0.52
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
PDE10A Q9Y233 1/20 0.51
CYSLTR2 Q9NS75 2/20 0.49
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C9 P11712 1/20 0.48
TSHR P16473 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48

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
SCHEMBL7065492 0.82 PDGFRB (0.73) PDGFRBPDGFRAMEN1KMT2ANPC1
SCHEMBL9529663 0.79 PDE10A (0.51) GPBAR1CYSLTR1PDE10ACYSLTR2
SCHEMBL7599570 0.77 GPBAR1 (0.82) GPBAR1CYSLTR1PDE10ACYSLTR2
SCHEMBL7801672 0.76 GPBAR1 (0.85) GPBAR1CYSLTR1PDE10ACYSLTR2
SCHEMBL10690965 0.75 CYSLTR1 (0.76) GPBAR1CYSLTR1PDE10ACYSLTR2
SCHEMBL9129064 0.75 GPBAR1 (0.82) GPBAR1CYSLTR1PDE10ACYSLTR2
SCHEMBL9201947 0.74 GPBAR1 (0.54) GPBAR1CYSLTR1CYP3A4CYP2C9
SCHEMBL7801642 0.74 GPBAR1 (0.81) GPBAR1CYSLTR1
SCHEMBL6389802 0.74 FLT3 (0.80) PDGFRBPDGFRAMEN1KMT2ANPC1
SCHEMBL6168456 0.73 MEN1 (0.70) PDGFRBPDGFRAMEN1KMT2ANPC1

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