SCHEMBL7786181

SCHEMBL7786181

CCCCCCCc1ccc(-c2cccc(F)c2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TAAR1 Q96RJ0 2/20 0.61
▸ RARB P10826 8/20 0.57
▸ RARA P10276 2/20 0.57
▸ RARG P13631 1/20 0.57
▸ HSD17B10 Q99714 2/20 0.51
▸ TSHR P16473 1/20 0.51
▸ MGLL Q99685 2/20 0.50
▸ ALDH1A1 P00352 2/20 0.50
▸ CYP3A4 P08684 2/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ MAPT P10636 1/20 0.50
▸ MTOR P42345 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ CYP17A1 P05093 1/20 0.50
▸ CYP11B1 P15538 1/20 0.50
▸ CYP11B2 P19099 1/20 0.50
▸ HSD11B1 P28845 1/20 0.48
▸ LPL P06858 3/20 0.47
▸ LIPG Q9Y5X9 3/20 0.47
▸ TRPV1 Q8NER1 1/20 0.47

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
SCHEMBL1817958 0.98 TAAR1 (0.63) TAAR1RARBRARARARGHSD17B10
SCHEMBL28632619 0.93 TAAR1 (0.65) TAAR1RARBRARARARGMGLL
SCHEMBL3172767 0.90 TAAR1 (0.50) TAAR1RARBRARARARGHSD17B10
SCHEMBL3158297 0.90 TAAR1 (0.50) TAAR1RARBRARARARGHSD17B10
SCHEMBL502723 0.89 TAAR1 (0.56) TAAR1RARBRARARARGHSD17B10
SCHEMBL3172512 0.88 TAAR1 (0.51) TAAR1RARBRARARARGMGLL
SCHEMBL3168333 0.88 TAAR1 (0.48) TAAR1RARBRARARARGMGLL
SCHEMBL3158490 0.88 TAAR1 (0.48) TAAR1RARBRARARARGMGLL
SCHEMBL502700 0.86 TAAR1 (0.69) TAAR1MGLLCYP3A4CYP17A1CYP11B1
SCHEMBL3159318 0.86 TAAR1 (0.49) TAAR1RARBRARARARGMGLL

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1144546-A3 FLUORINATED TERPHENYLS QinetiQ Limited (GB) 2002-08-28 — — EP disclosed
EP-1144546-A2 FLUORINATED TERPHENYLS QinetiQ Limited (GB) 2001-10-17 — — EP disclosed
WO-2000004111-A2 FLUORINATED TERPHENYLS THE SECRETARY OF STATE FOR DEFENCE (GB) 2000-01-27 — — WO disclosed
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