SCHEMBL7140733

SCHEMBL7140733

CC=C(CC)Oc1ccc(Br)cc1C(C)(C)C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 3/20 0.51
USP2 O75604 3/20 0.39
ALOX15 P16050 2/20 0.39
ALPL P05186 1/20 0.39
TSHR P16473 3/20 0.36
HPGD P15428 2/20 0.36
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
HTT P42858 2/20 0.33
RBP4 P02753 1/20 0.33
GLA P06280 1/20 0.33
ALDH1A1 P00352 3/20 0.32
MAPK1 P28482 2/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
KDM4E B2RXH2 2/20 0.31
TDP1 Q9NUW8 2/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
GAA P10253 1/20 0.31

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
SCHEMBL7140065 0.76 PTGDR2 (0.33) PTGDR2ALOX15HSD17B10
SCHEMBL3982874 0.76 PTGDR2 (0.62) PTGDR2USP2ALOX15ALPLSMN1; SMN2
SCHEMBL16217687 0.75 PTGDR2 (0.57) PTGDR2USP2ALOX15ALPLMEN1
SCHEMBL3982876 0.74 PTGDR2 (0.65) PTGDR2USP2ALOX15ALPLMEN1
SCHEMBL13748304 0.74 PTGDR2 (0.64) PTGDR2USP2ALOX15ALPLTSHR
SCHEMBL29210715 0.74 PTGDR2 (0.56) PTGDR2USP2ALOX15ALPLTSHR
SCHEMBL399302 0.72 PTGDR2 (0.57) PTGDR2USP2ALOX15ALPLHPGD
SCHEMBL7717554 0.71 PTGDR2 (0.60) PTGDR2USP2ALOX15ALPLTSHR
SCHEMBL1542948 0.71 PTGDR2 (0.56) PTGDR2USP2ALOX15ALPLTSHR
SCHEMBL29426974 0.71 PTGDR2 (0.56) PTGDR2USP2ALOX15ALPLTSHR

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-0907646-B1 DIHYDROBENZOPYRAN AND RELATED COMPOUNDS USEFUL AS ANTI-INFLAMMATORY AGENTS UNIV VANDERBILT (US) 2003-05-21 EP disclosed
US-6110960-A FOR TREATING ARTHRITIS AND AS ANALGESIC THE PROCTER & GAMBLE COMPANY (US) 2000-08-29 US disclosed