SCHEMBL7942699

SCHEMBL7942699

CC(C)(C)[C@H](Nc1ccc(F)cc1)C(=O)N1CCC[C@H]1C(N)=O

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 1/20 0.46
▸ ALOX12 P18054 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ DPP4 P27487 3/20 0.46
▸ HTR1A P08908 1/20 0.41
▸ HTR7 P34969 1/20 0.41
▸ SCN9A Q15858 1/20 0.41
▸ APOL1 O14791 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ ELANE P08246 2/20 0.39
▸ CCR1 P32246 2/20 0.38
▸ PIK3CA P42336 2/20 0.38
▸ PIK3CD O00329 1/20 0.38
▸ PIK3CB P42338 1/20 0.38
▸ PIK3CG P48736 1/20 0.38

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
SCHEMBL7943694 0.88 ELANE (0.46) DPP4ALDH1A1ELANE
SCHEMBL7997452 0.81 TRPV1 (0.47) SCN9APIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL1688348 0.77 SPHK1 (0.43) KMT2ADPP4HTR1AHTR7ALDH1A1
SCHEMBL7944997 0.76 DPP4 (0.40) DPP4ELANEPIK3CA
SCHEMBL20388035 0.76 DPP4 (0.40) DPP4ELANEPIK3CA
SCHEMBL3726967 0.75 DPP4 (0.42) DPP4ELANE
SCHEMBL17188738 0.75 PIK3CA (0.42) DPP4APOL1PIK3CAPIK3CDPIK3CB
SCHEMBL10069866 0.75 EPHX2 (0.43) KMT2A
SCHEMBL1688344 0.74 EPHX2 (0.42) KMT2A
SCHEMBL24051779 0.73 ELANE (0.42) ELANE

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-2010045266-A1 THERAPEUTIC ANTIVIRAL PEPTIDES INTERMUNE, INC. (US) 2010-04-22 — — WO disclosed
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