SCHEMBL14628382

SCHEMBL14628382

C=C(C)[C@@H]1CCC2(C(=O)NCc3cccc(OC(F)(F)F)c3)CC[C@]3(C)[C@H](CCC4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)C12

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 1/20 0.72
▸ RORC P51449 15/20 0.65
▸ EGLN2 Q96KS0 1/20 0.61
▸ EGLN1 Q9GZT9 1/20 0.61
▸ EGLN3 Q9H6Z9 1/20 0.61
▸ P4HTM Q9NXG6 1/20 0.61
▸ ALB P02768 2/20 0.58
▸ PTPN1 P18031 2/20 0.58
▸ USP2 O75604 1/20 0.58
▸ LMNA P02545 1/20 0.58
▸ HIF1A Q16665 1/20 0.58
▸ AKR1B10 O60218 1/20 0.58
▸ POLB P06746 1/20 0.58
▸ GLI1 P08151 1/20 0.58
▸ AKR1B1 P15121 1/20 0.58
▸ NT5E P21589 1/20 0.58
▸ DPP4 P27487 1/20 0.58
▸ GPBAR1 Q8TDU6 1/20 0.58
▸ SAE1 Q9UBE0 1/20 0.58
▸ UBA2 Q9UBT2 1/20 0.58

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
SCHEMBL12557993 1.00 TRPV1 (0.72) TRPV1RORCEGLN2EGLN1EGLN3
SCHEMBL12558017 0.93 TRPV1 (0.72) TRPV1RORCEGLN2EGLN1EGLN3
SCHEMBL12557934 0.92 TRPV1 (0.81) TRPV1RORCEGLN2EGLN1EGLN3
SCHEMBL12557886 0.91 TRPV1 (0.62) TRPV1RORCPTPN1NT5E
SCHEMBL13637466 0.89 TRPV1 (0.76) TRPV1RORCEGLN2EGLN1EGLN3
SCHEMBL13628219 0.89 TRPV1 (0.76) TRPV1RORCEGLN2EGLN1EGLN3
SCHEMBL4213368 0.88 TRPV1 (0.76) TRPV1RORCEGLN2EGLN1EGLN3
SCHEMBL12558127 0.87 PTPN1 (0.69) TRPV1RORCPTPN1NT5E
SCHEMBL4442339 0.87 TRPV1 (0.74) TRPV1RORCEGLN2EGLN1EGLN3
SCHEMBL13628230 0.87 TRPV1 (0.74) TRPV1RORCEGLN2EGLN1EGLN3

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
WO-2007002411-A1 ANTIVIRAL COMPOUNDS MYRIAD GENETICS, INC. (US) 2007-01-04 — — WO disclosed
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