SCHEMBL13201470

SCHEMBL13201470

CCc1cc2cc(C(=O)O)ccc2s1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 1/20 0.56
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
DAO P14920 1/20 0.46
MAPK1 P28482 1/20 0.45
HSD17B10 Q99714 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
ALDH1A1 P00352 1/20 0.43
KDM4E B2RXH2 2/20 0.41
GRIN2C Q14957 1/20 0.41
RXRA P19793 1/20 0.40
RXRB P28702 1/20 0.40
LMNA P02545 1/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
HRH3 Q9Y5N1 1/20 0.38
HDAC1 Q13547 2/20 0.38

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
SCHEMBL29120040 0.83 TBXAS1 (0.56) TBXAS1NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL30674067 0.83 TBXAS1 (0.56) TBXAS1NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL6299629 0.77 SMN1; SMN2 (0.57) TBXAS1NPC1RAB9ASMN1; SMN2DAO
SCHEMBL13791093 0.75 DYRK1A (0.51) MAPTHTT
SCHEMBL4082326 0.75 BCL2L1 (0.61) TBXAS1NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL9612673 0.75 DYRK1A (0.65) TBXAS1NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL18936125 0.74 NPC1 (0.49) TBXAS1NPC1RAB9ASMN1; SMN2HSD17B10
SCHEMBL22672602 0.73 SMN1; SMN2 (0.49) TBXAS1NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL10222545 0.73 CYP2A6 (0.45) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL6958993 0.73 CYP2A6 (0.50) RAB9AKDM4ELMNAMAPT

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
US-7772285-B2 Benzophenone derivatives or salts thereof TOYAMA CHEMICAL CO., LTD. (JP) 2010-08-10 US disclosed
US-7772285-B2 Benzophenone derivatives or salts thereof TOYAMA CHEMICAL CO., LTD. (JP) 2010-08-10 US disclosed