SCHEMBL14049869

SCHEMBL14049869

CCOC(=O)CNC(=O)c1cccc(CCNC(=O)C23CCCC2C2CCC4C(C)(CCC5C(C)(C)C(O)CCC54C)C2CC3)c1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ NR1H4 Q96RI1 1/20 0.36
▸ TRPV1 Q8NER1 1/20 0.35
▸ RORC P51449 6/20 0.34
▸ PTPN1 P18031 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.33
▸ ABCB1 P08183 1/20 0.33

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
SCHEMBL14049778 0.90 NR1H4 (0.40) HSD17B10TDP1NR1H4TRPV1RORC
SCHEMBL14049851 0.89 NR1H4 (0.41) HSD17B10TDP1NR1H4RORCPTPN1
SCHEMBL14049665 0.88 NR1H4 (0.37) HSD17B10TDP1NR1H4TRPV1RORC
SCHEMBL14049973 0.87 PTPN1 (0.39) HSD17B10TDP1NR1H4TRPV1RORC
SCHEMBL14049871 0.86 NR1H4 (0.41) HSD17B10TDP1NR1H4TRPV1RORC
SCHEMBL14049834 0.86 RORC (0.36) HSD17B10TDP1NR1H4TRPV1RORC
SCHEMBL14049777 0.86 NR1H4 (0.36) HSD17B10TDP1NR1H4TRPV1RORC
SCHEMBL14049664 0.86 PTPN1 (0.40) HSD17B10TDP1NR1H4TRPV1RORC
SCHEMBL14049779 0.86 NR1H4 (0.41) HSD17B10TDP1NR1H4TRPV1RORC
SCHEMBL14049659 0.86 NR1H4 (0.38) HSD17B10TDP1NR1H4TRPV1RORC

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-2008127364-A2 ANTIVIRAL COMPOUNDS AND USE THEREOF MYRIAD GENETICS, INC. (US) 2008-10-23 — — WO disclosed
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