SCHEMBL19117165

SCHEMBL19117165

CCc1ncc(C2CC2)[nH]1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 2/20 0.35
▸ BRS3 P32247 1/20 0.35
▸ NPY5R Q15761 1/20 0.34
▸ DAO P14920 1/20 0.31
▸ CCR5 P51681 1/20 0.31
▸ YTHDF2 Q9Y5A9 2/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ YTHDF3 Q7Z739 1/20 0.31
▸ YTHDF1 Q9BYJ9 1/20 0.31
▸ CCNA2 P20248 1/20 0.30
▸ CDK2 P24941 1/20 0.30
▸ CCNA1 P78396 1/20 0.30
▸ IGF1R P08069 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
SCHEMBL19116608 0.92 BRS3 (0.39) KDM1ABRS3NPY5RDAOCCR5
SCHEMBL19521677 0.91 NPY5R (0.44) KDM1ABRS3NPY5RDAOCCR5
SCHEMBL19521578 0.88 IDO1 (0.33) KDM1ABRS3RAB9A
SCHEMBL19521676 0.82 CCR5 (0.33) BRS3CCR5
SCHEMBL28576254 0.80 BRS3 (0.35) KDM1ABRS3NPY5RDAOYTHDF2
SCHEMBL12685102 0.72 — —
SCHEMBL19077856 0.72 KDM1A (0.35) KDM1ANPY5RYTHDF2YTHDF3YTHDF1
SCHEMBL19087053 0.72 CCNA2 (0.32) KDM1ANPY5RCCR5CCNA2CDK2
SCHEMBL15586080 0.71 F10 (0.35) KDM1ANPY5RMAPT
SCHEMBL22365025 0.68 — —

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-2017120194-A1 PYRIDINE AND PYRIDIMINE COMPOUNDS AS PI3K-GAMMA INHIBITORS INCYTE CORPORATION (US) 2017-07-13 — — WO disclosed
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