SCHEMBL29005279

SCHEMBL29005279

CON(C)C(=O)c1cnc(OC(F)C(F)F)cn1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SIRT6 Q8N6T7 1/20 0.39
OXTR P30559 8/20 0.35
AVPR1A P37288 4/20 0.35
GCK P35557 3/20 0.35
AVPR2 P30518 2/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
MLYCD O95822 1/20 0.31

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
SCHEMBL16601358 0.81 SIRT6 (0.59) SIRT6OXTRAVPR1AGCKAVPR2
SCHEMBL29005254 0.78 NNMT (0.40) MLYCD
SCHEMBL29005159 0.77 SIRT6 (0.42) SIRT6
SCHEMBL29005276 0.75 L3MBTL1 (0.43) SIRT6OXTRAVPR1AMLYCD
SCHEMBL30342136 0.75 L3MBTL1 (0.43) SIRT6OXTRAVPR1AMLYCD
SCHEMBL2882770 0.74 KMT2A (0.49) OXTRAVPR1AMEN1KMT2A
SCHEMBL17819683 0.71 MEN1 (0.36) SIRT6OXTRAVPR1AAVPR2MEN1
SCHEMBL2304361 0.71 SIRT6 (0.50) SIRT6OXTRAVPR1AMEN1KMT2A
SCHEMBL24774974 0.71 MLYCD (0.40) SIRT6OXTRAVPR1AGCKMEN1
SCHEMBL30108431 0.71 MLYCD (0.40) SIRT6OXTRAVPR1AGCKMEN1

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
CN-116134018-A 2-oxoimidazolidine-4-carboxamide as NAV1.8 inhibitor 默沙东有限责任公司 2023-05-16 CN disclosed