SCHEMBL20053601

SCHEMBL20053601

CC(C)(F)CN1CCC(COc2ccc(-c3ccc(C(=O)N4CCCCC4)cc3F)cc2C#N)CC1

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 16/20 0.44
XDH P47989 2/20 0.43
KCNH2 Q12809 1/20 0.41
HRH3 Q9Y5N1 1/20 0.41

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
SCHEMBL15538537 0.92 KDM1A (0.46) KDM1AXDH
SCHEMBL15538798 0.92 KDM1A (0.46) KDM1AXDH
SCHEMBL15538534 0.92 KDM1A (0.46) KDM1AXDH
SCHEMBL20053638 0.90 XDH (0.47) XDHHRH3
SCHEMBL15538373 0.90 XDH (0.49) KDM1AXDHKCNH2
SCHEMBL21534990 0.89 XDH (0.46) XDHHRH3
SCHEMBL15559518 0.88 XDH (0.41) KDM1AXDH
SCHEMBL20053560 0.87 PDK2 (0.42) KDM1AXDH
SCHEMBL20053580 0.86 HRH3 (0.44) KDM1AKCNH2HRH3
SCHEMBL20053539 0.85 XDH (0.42) XDHKCNH2HRH3

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
US-9944600-B2 Piperidine derivatives for GPR119 agonist CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2018-04-17 US disclosed