SCHEMBL14300404

SCHEMBL14300404

C#Cc1ccc(N[C@H](CNCCC)CC(=O)OC(C)(C)C)cc1Cl

nearest known ligand 0.31

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ NPSR1 Q6W5P4 1/20 0.30
▸ RORC P51449 1/20 0.30

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
SCHEMBL13108643 0.90 RORC (0.39) GAARORC
SCHEMBL12345114 0.85 STAT3 (0.32) MEN1KMT2AKDM4EGAAMAPT
SCHEMBL14300268 0.85 GAA (0.31) MEN1KMT2AKDM4EGAAMAPT
SCHEMBL27777714 0.82 RORC (0.40) GAARORC
SCHEMBL13108632 0.82 RORC (0.40) GAARORC
SCHEMBL12345098 0.81 AR (0.36) GAARORC
SCHEMBL13108641 0.80 RORC (0.40) MEN1KMT2AKDM4EGAAMAPT
SCHEMBL13108636 0.79 AR (0.38) GAARORC
SCHEMBL13108623 0.78 AR (0.40) GAARORC
SCHEMBL27756886 0.78 AR (0.40) GAARORC

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
WO-2014134566-A2 THERAPEUTIC COMPOUNDS GILEAD SCIENCES, INC. (US) 2014-09-04 — — WO disclosed
WO-2008021796-A2 PYRROLIDINONE ANILINES AS PROGESTERONE RECEPTOR MODULATORS SMITHKLINE BEECHAM CORPORATION (US) 2008-02-21 — — WO disclosed
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