SCHEMBL9592172

SCHEMBL9592172

CC1(C(=O)O)CC(F)(F)C1(F)Cl

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
HPGD P15428 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
GAA P10253 1/20 0.31

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
Hydrochloric Acid SCHEMBL9593954 0.98 FFAR3 (0.32) FFAR3SMN1; SMN2
SCHEMBL9593948 0.82 SMN1; SMN2 (0.32) SMN1; SMN2HPGDNPSR1GAA
SCHEMBL9592171 0.80 PKM (0.37) SMN1; SMN2
SCHEMBL8523602 0.78
SCHEMBL248540 0.78
SCHEMBL31487839 0.78
SCHEMBL9592601 0.77 MEN1 (0.40) SMN1; SMN2HPGDNPSR1GAA
Hydrochloric Acid SCHEMBL9313203 0.75 FFAR3 (0.39) FFAR3SMN1; SMN2NPSR1
SCHEMBL248943 0.72
SCHEMBL21410865 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5183932-A Chemical intermediates BAYER AKTIENGESELLSCHAFT (DE) 1993-02-02 US disclosed
US-5169427-A Herbicides BAYER AKTIENGESELLSCHAFT (DE) 1992-12-08 US disclosed
EP-0391187-B1 SUBSTITUTED 4-AMINO-5-ALKYLTHIO-1,2,4-TRIAZOL-3-ONES BAYER AG (DE) 1992-11-11 EP disclosed
US-5097050-A Intermediates for synthesis of fungicidal hydroxyalkinyl-azoles BAYER AKTIENGESELLSCHAFT (DE) 1992-03-17 US disclosed
EP-0460479-A1 Cycloalkyl substituted thiadiazolyloxyacetamides BAYER AG (DE) 1991-12-11 EP disclosed
US-5049633-A Ethylene/polycyclic monomer copolymer, process for preparation thereof, and optical article SHOWA DENKO K.K. (JP) 1991-09-17 US disclosed
US-5025030-A Fungicides BAYER AKTIENGESELLSCHAFT (DE) 1991-06-18 US disclosed
US-5021080-A Pre-and/or postemergence; selectivity BAYER AKTIENGESELLSCHAFT (DE) 1991-06-04 US disclosed
EP-0351646-A2 Hydroxyalkinyl-azolyl derivatives BAYER AG (DE) 1990-01-24 EP disclosed