SCHEMBL9320795

SCHEMBL9320795

FC(F)(F)c1ccc2oc(CBr)nc2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.45
SLC27A1 Q6PCB7 1/20 0.42
KDM4E B2RXH2 2/20 0.39
PIM1 P11309 1/20 0.39
PIM2 Q9P1W9 1/20 0.39
HDAC3 O15379 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
AGPAT2 O15120 2/20 0.38
GRK6 P43250 1/20 0.38
UTRN P46939 1/20 0.38
ELANE P08246 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
HSPD1 P10809 1/20 0.36
PTPN2 P17706 1/20 0.36
PTPN1 P18031 1/20 0.36
PTPN5 P54829 1/20 0.36

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
SCHEMBL11934534 0.84 GAA (0.51) AKR1B1SLC27A1KDM4EPIM1PIM2
SCHEMBL15707863 0.84 AKR1B1 (0.45) AKR1B1SLC27A1KDM4EPIM1PIM2
SCHEMBL30612620 0.84 AKR1B1 (0.45) AKR1B1SLC27A1KDM4EPIM1PIM2
SCHEMBL2792614 0.84 AKR1B1 (0.45) AKR1B1SLC27A1KDM4EPIM1PIM2
SCHEMBL21130280 0.83 AKR1B1 (0.44) AKR1B1SLC27A1KDM4EPIM1PIM2
SCHEMBL10897276 0.81 AKR1B1 (0.51) AKR1B1SLC27A1KDM4EPIM1PIM2
SCHEMBL10897279 0.79 AKR1B1 (0.49) AKR1B1SLC27A1KDM4EPIM1PIM2
SCHEMBL6930158 0.78 PIK3CD (0.43) KDM4EGRK6ELANEMEN1KMT2A
SCHEMBL19899503 0.78 HDAC3 (0.44) AKR1B1KDM4EPIM1PIM2HDAC3
SCHEMBL9207558 0.76 XDH (0.43) AKR1B1KDM4EHDAC6GRK6ELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5330997-A 1H-indazole-3-acetic acids as aldose reductase inhibitors PFIZER INC. (US) 1994-07-19 US disclosed
US-5236945-A 1H-indazole-3-acetic acids as aldose reductase inhibitors PFIZER INC. (US) 1993-08-17 US disclosed
EP-0325375-B1 1H-INDAZOLE-3-ACETIC ACIDS AS ALDOSE REDUCTASE INHIBITORS PFIZER INC. (US) 1992-08-12 EP disclosed
WO-1989006651-A1 1H-INDAZOLE-3-ACETIC ACIDS AS ALDOSE REDUCTASE INHIBITORS PFIZER INC. (US) 1989-07-27 WO disclosed
EP-0325375-A1 1H-indazole-3-acetic acids as aldose reductase inhibitors PFIZER INC. (US) 1989-07-26 EP disclosed