SCHEMBL11565320

SCHEMBL11565320

CN(Cc1ccccc1)c1ccc(C(=O)O)cn1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR3 P49019 2/20 0.64
USP30 Q70CQ3 1/20 0.53
GAA P10253 1/20 0.48
CXCR1 P25024 2/20 0.47
CXCR2 P25025 2/20 0.47
TRPM8 Q7Z2W7 1/20 0.46
LDHA P00338 1/20 0.45
RXRA P19793 3/20 0.45
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
MAPT P10636 2/20 0.43
AGTR1 P30556 1/20 0.43
AGTR2 P50052 1/20 0.43
TSHR P16473 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
P4HA1 P13674 1/20 0.43
P4HTM Q9NXG6 1/20 0.43
TAS2R14 Q9NYV8 1/20 0.43
PKM P14618 1/20 0.43
HDAC1 Q13547 1/20 0.43

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
SCHEMBL11565561 0.92 HCAR3 (0.66) HCAR3USP30CXCR1CXCR2RXRA
SCHEMBL26835972 0.91 USP30 (0.53) HCAR3USP30GAACXCR1CXCR2
SCHEMBL11560456 0.88 HCAR3 (0.61) HCAR3USP30CXCR1CXCR2RXRA
SCHEMBL11566151 0.85 HCAR3 (0.69) HCAR3USP30LDHARXRAMAPT
SCHEMBL1720417 0.84 HCAR3 (0.60) HCAR3CXCR1CXCR2TRPM8LDHA
SCHEMBL11563144 0.83 HCAR3 (0.66) HCAR3RXRAPKMHDAC1
SCHEMBL11566168 0.82 HCAR3 (0.62) HCAR3CXCR1CXCR2TRPM8LDHA
SCHEMBL11564474 0.82 HCAR3 (0.54) HCAR3USP30GAACXCR1CXCR2
SCHEMBL11564059 0.82 HCAR3 (0.64) HCAR3RXRAPKMHDAC1
SCHEMBL11564719 0.81 HCAR3 (0.63) HCAR3RXRAPKM

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
EP-0000816-A1 Substituted amino-pyridine derivatives, processes for their preparation and pharmaceutical compositions containing them BEECHAM GROUP PLC (GB) 1979-02-21 EP disclosed