SCHEMBL17025792

SCHEMBL17025792

CCc1c(OC)cccc1C(=O)N(NC(CC)C(C)(C)C)C(=O)c1cc(C)cc(C)c1

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 5/20 0.47
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
CYP3A4 P08684 1/20 0.35

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
SCHEMBL14801637 0.92 ABCB1 (0.46) ABCB1NPC1RAB9A
SCHEMBL16163199 0.92 ABCB1 (0.46) ABCB1NPC1RAB9A
SCHEMBL14801560 0.92 ABCB1 (0.46) ABCB1NPC1RAB9A
SCHEMBL17025770 0.92 ABCB1 (0.40) ABCB1NPC1RAB9A
SCHEMBL9101450 0.90 ABCB1 (0.56) ABCB1NPC1RAB9A
SCHEMBL2482845 0.85 ABCB1 (0.51) ABCB1NPC1RAB9ACYP3A4
SCHEMBL17025742 0.85 ABCB1 (0.39) ABCB1
SCHEMBL17025752 0.83 ABCB1 (0.47) ABCB1
SCHEMBL19946425 0.82 ABCB1 (0.54) ABCB1NPC1RAB9A
SCHEMBL22363210 0.82 ABCB1 (0.54) ABCB1NPC1RAB9A

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
US-20150240244-A1 BIOAVAILABLE DIACYLHYDRAZINE LIGANDS FOR MODULATING THE EXPRESSION OF EXOGENOUS GENES VIA AN ECDYSONE RECEPTOR COMPLEX BIOPHARMA CREDIT PLC, AS COLLATERAL AGENT (GB) 2015-08-27 US claimed
EP-4382913-A2 MODULATING EXPRESSION OF POLYPEPTIDES VIA NEW GENE SWITCH EXPRESSION SYSTEMS Precigen, Inc. (US) 2024-06-12 EP disclosed
EP-2463269-B1 Bioavailable diacylhydrazine ligands for modulating the expression of exogenous genes via an ecdysone receptor complex INTREXON CORP (US) 2016-09-28 EP disclosed