SCHEMBL13478792

SCHEMBL13478792

CN(C)C(=O)NC1CCc2c(c3cc(N)ccc3n2Cc2cccc(F)c2)C1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 19/20 0.48
HDAC3 O15379 1/20 0.40
HDAC4 P56524 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC7 Q8WUI4 1/20 0.40
HDAC10 Q969S8 1/20 0.40
HDAC11 Q96DB2 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
HDAC9 Q9UKV0 1/20 0.40
HDAC5 Q9UQL6 1/20 0.40

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
SCHEMBL14623643 0.92 PTGDR2 (0.46) PTGDR2
SCHEMBL1878612 0.90 PTGDR2 (0.48) PTGDR2HDAC3HDAC4HDAC1HDAC7
SCHEMBL13478767 0.89 PTGDR2 (0.47) PTGDR2HDAC3HDAC4HDAC1HDAC7
SCHEMBL14625198 0.89 PTGDR2 (0.47) PTGDR2HDAC3HDAC4HDAC1HDAC7
SCHEMBL1877119 0.88 PTGDR2 (0.47) PTGDR2
SCHEMBL14624694 0.88 PTGDR2 (0.47) PTGDR2HDAC3HDAC4HDAC1HDAC7
SCHEMBL14624682 0.87 PTGDR2 (0.45) PTGDR2HDAC1HDAC6
SCHEMBL12637106 0.86 PTGDR2 (0.46) PTGDR2
SCHEMBL14624592 0.85 PTGDR2 (0.42) PTGDR2
SCHEMBL14623711 0.84 PTGDR2 (0.48) PTGDR2

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
EP-1902026-B1 TETRAHYDROCARBAZOLE DERIVATIVES USEFUL AS ANDROGEN RECEPTOR MODULATORS (SARM) LILLY CO ELI (US) 2010-02-17 EP disclosed
WO-2007002181-A2 TETRAHYDROCARBAZOLE DERIVATIVES USEFUL AS ANDROGEN RECEPTOR MODULATORS (SARM) ELI LILLY AND COMPANY (US) 2007-01-04 WO disclosed