SCHEMBL11518243

SCHEMBL11518243

CCC(Oc1ccccc1Cc1ccccc1)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARG P37231 9/20 0.49
PPARA Q07869 7/20 0.49
HRH1 P35367 4/20 0.45
DRD2 P14416 2/20 0.44
DRD1 P21728 2/20 0.44
DRD3 P35462 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44
DRD4 P21917 1/20 0.43
DRD5 P21918 1/20 0.43
L3MBTL1 Q9Y468 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
SCHEMBL5861928 0.87 SMN1; SMN2 (0.49) PPARGPPARASMN1; SMN2L3MBTL1
SCHEMBL8935961 0.87 SMN1; SMN2 (0.49) PPARGPPARASMN1; SMN2L3MBTL1
SCHEMBL3144299 0.84 PPARA (0.50) PPARGPPARASMN1; SMN2
SCHEMBL10983124 0.81 KMT2A (0.58) HRH1DRD2DRD1SMN1; SMN2MAOA
SCHEMBL8562527 0.81 SLC1A1 (0.47) PPARGPPARAHRH1SMN1; SMN2
SCHEMBL8562536 0.81 SLC1A1 (0.47) PPARGPPARAHRH1SMN1; SMN2
SCHEMBL8935641 0.81 SMN1; SMN2 (0.57) PPARGPPARASMN1; SMN2
SCHEMBL3879629 0.81 SMN1; SMN2 (0.57) PPARGPPARASMN1; SMN2
SCHEMBL28512555 0.80 DRD1 (0.48) HRH1DRD2DRD1DRD3SMN1; SMN2
SCHEMBL8935860 0.79 KDM4E (0.45) SMN1; SMN2L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4155905-A 6-Substituted penicillanic acid and derivatives thereof E. R. SQUIBB & SONS, INC. (US) 1979-05-22 US disclosed
US-4077967-A 6-Substituted penicillanic acid and derivatives thereof E. R. SQUIBB & SONS, INC. (US) 1978-03-07 US disclosed
US-4061629-A 6-Amino-6-arylthio penicillanic acids and derivatives thereof E. R. SQUIBB & SONS, INC. (US) 1977-12-06 US disclosed
US-4061851-A 7-Amino-7-arylthio cephalosporins E. R. SQUIBB & SONS, INC. (US) 1977-12-06 US disclosed
US-4029669-A 6-Benzalimino-6-arylthio penicillanic acids and derivatives thereof E. R. SQUIBB & SONS, INC. (US) 1977-06-14 US disclosed
US-4026886-A 7-Acyl-7-arylthiocephalosporins E. R. SQUIBB & SONS, INC. (US) 1977-05-31 US disclosed
US-3965093-A 6-Arylthio penicillanic acid and derivatives thereof E. R. SQUIBB & SONS, INC. (US) 1976-06-22 US disclosed
US-3954744-A ANTIBACTERIAL E. R. SQUIBB & SONS, INC. (US) 1976-05-04 US disclosed