SCHEMBL30753154

SCHEMBL30753154

NC(=O)Nc1ccc(C(=O)O)cn1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR3 P49019 16/20 0.65
GABRP O00591 1/20 0.53
GABRD O14764 1/20 0.53
GABRA1 P14867 1/20 0.53
GABRB1 P18505 1/20 0.53
GABRG2 P18507 1/20 0.53
GABRB3 P28472 1/20 0.53
GABRA5 P31644 1/20 0.53
GABRA3 P34903 1/20 0.53
GABRA2 P47869 1/20 0.53
GABRB2 P47870 1/20 0.53
GABRA4 P48169 1/20 0.53
GABRE P78334 1/20 0.53
GABRA6 Q16445 1/20 0.53
GABRG1 Q8N1C3 1/20 0.53
GABRG3 Q99928 1/20 0.53
GABRQ Q9UN88 1/20 0.53
HCAR2 Q8TDS4 2/20 0.53
P4HA1 P13674 2/20 0.52
P4HTM Q9NXG6 2/20 0.52

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
SCHEMBL29153416 1.00 HCAR3 (0.65) HCAR3GABRPGABRDGABRA1GABRB1
SCHEMBL2863008 0.86 HCAR3 (0.61) HCAR3GABRPGABRDGABRA1GABRB1
SCHEMBL82675 0.81 HCAR3 (0.68) HCAR3HCAR2
SCHEMBL29505896 0.81 HCAR3 (0.67) HCAR3GABRPGABRDGABRA1GABRB1
SCHEMBL158601 0.81 HCAR3 (0.67) HCAR3GABRPGABRDGABRA1GABRB1
SCHEMBL14341697 0.80 HCAR3 (0.76) HCAR3GABRPGABRDGABRA1GABRB1
Ammonia Solution, Strong SCHEMBL28249483 0.79 HCAR3 (0.65) HCAR3GABRPGABRDGABRA1GABRB1
Hydrochloric Acid SCHEMBL5789616 0.79 HCAR3 (0.65) HCAR3GABRPGABRDGABRA1GABRB1
SCHEMBL2664544 0.79 HCAR3 (1.00) HCAR3
SCHEMBL10033268 0.79 HCAR3 (0.64) HCAR3HCAR2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117285533-B CD47/SIRP alpha small molecule inhibitor, application thereof and anti-tumor pharmaceutical composition 四川省医学科学院·四川省人民医院 2024-01-30 CN disclosed
CN-117285533-A CD47/SIRP alpha small molecule inhibitor, application thereof and anti-tumor pharmaceutical composition 四川省医学科学院·四川省人民医院 2023-12-26 CN disclosed