SCHEMBL30323180

SCHEMBL30323180

CC(=O)n1ncc2ccc(NC(=O)c3ccccn3)cc21

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ GRM4 Q14833 12/20 0.52
▸ KDR P35968 3/20 0.52
▸ NPC1 O15118 4/20 0.51
▸ RAB9A P51151 4/20 0.51
▸ SMN1; SMN2 Q16637 4/20 0.51
▸ KDM4E B2RXH2 1/20 0.51
▸ HDAC6 Q9UBN7 2/20 0.49
▸ MAPT P10636 2/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ USP2 O75604 1/20 0.48
▸ TP53 P04637 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ PKM P14618 1/20 0.48
▸ KCNK3 O14649 1/20 0.48
▸ KCNK9 Q9NPC2 1/20 0.48

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
SCHEMBL22712288 1.00 GRM4 (0.52) GRM4KDRNPC1RAB9ASMN1; SMN2
SCHEMBL20524569 0.85 GRM4 (0.54) GRM4KDRNPC1RAB9ASMN1; SMN2
SCHEMBL30323212 0.85 GRM4 (0.54) GRM4KDRNPC1RAB9ASMN1; SMN2
SCHEMBL30904872 0.75 KDR (0.84) GRM4KDRNPC1RAB9ASMN1; SMN2
SCHEMBL5381037 0.74 LMNA (0.50) GRM4KDRNPC1RAB9ASMN1; SMN2
SCHEMBL16592903 0.72 NPC1 (0.69) GRM4KDRNPC1RAB9ASMN1; SMN2
SCHEMBL7990375 0.71 KDR (0.84) GRM4KDRNPC1RAB9ASMN1; SMN2
SCHEMBL12764167 0.71 GRM4 (0.72) GRM4KDRNPC1RAB9ASMN1; SMN2
SCHEMBL20524671 0.71 NOTUM (0.56) GRM4KDRNPC1RAB9ASMN1; SMN2
SCHEMBL30323171 0.71 NOTUM (0.56) GRM4KDRNPC1RAB9ASMN1; SMN2

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-110520127-B Piperidinyl-substituted and piperazinyl-substituted heteroaromatic carboxamides as modulators of GPR6 武田药品工业株式会社 2023-05-16 — — CN disclosed
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