Cyclopropane Carboxylic Acid

Cyclopropane Carboxylic Acid

SCHEMBL28887293

NC(=O)c1ccc(-n2ccc3cc(C(=O)N4CCC(F)(F)CC4)cnc32)cn1.O=C(O)C1CC1

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.44
MGLL Q99685 1/20 0.42
ITGB3 P05106 1/20 0.37
ITGA2B P08514 1/20 0.37
VNN1 O95497 1/20 0.35
HRH3 Q9Y5N1 2/20 0.34
ADRA1A P35348 2/20 0.34
DDR1 Q08345 1/20 0.34
JAK2 O60674 1/20 0.33
JAK1 P23458 1/20 0.33
JAK3 P52333 1/20 0.33
LRRK2 Q5S007 1/20 0.33
DHFR P00374 1/20 0.33
PRKAA2 P54646 1/20 0.33
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL24942616 0.93 HPGD (0.50) HPGDMGLLVNN1HRH3DDR1
SCHEMBL31038242 0.93 HPGD (0.50) HPGDMGLLVNN1HRH3DDR1
SCHEMBL29564966 0.86 HPGD (0.51) HPGDMGLLVNN1ADRA1ADDR1
SCHEMBL23675278 0.86 HPGD (0.51) HPGDMGLLVNN1ADRA1ADDR1
SCHEMBL23680795 0.85 HPGD (0.51) HPGDMGLLVNN1HRH3PRKAA2
SCHEMBL29141099 0.84 HPGD (0.45) HPGDMGLLVNN1ADRA1ADDR1
SCHEMBL23675218 0.84 HPGD (0.47) HPGDMGLLVNN1ADRA1ADDR1
SCHEMBL23675215 0.84 HPGD (0.47) HPGDMGLLVNN1ADRA1ADDR1
SCHEMBL29565058 0.84 HPGD (0.47) HPGDMGLLVNN1ADRA1ADDR1
SCHEMBL23680713 0.83 HPGD (0.53) HPGDMGLLVNN1ADRA1ADDR1

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-115335043-A PGDH inhibitors and methods of making and using 迈欧伏特治疗公司 2022-11-11 CN disclosed