SCHEMBL26290

SCHEMBL26290

Oc1ccc(C(O)c2cc(Br)ccc2F)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.40
ADRA2A P08913 1/20 0.38
ADRA2B P18089 1/20 0.38
ADRA2C P18825 1/20 0.38
GUSB P08236 1/20 0.38
CYP17A1 P05093 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP19A1 P11511 1/20 0.36
CYP11B1 P15538 1/20 0.36
CYP11B2 P19099 1/20 0.36
ESR1 P03372 5/20 0.34
ESR2 Q92731 5/20 0.34
BCL2 P10415 1/20 0.33
MCL1 Q07820 1/20 0.33
DPP4 P27487 1/20 0.33
GLB1 P16278 1/20 0.33
CTRB1 P17538 1/20 0.33
CTRC Q99895 1/20 0.33
DGAT1 O75907 1/20 0.33
HTR3A P46098 1/20 0.32

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
SCHEMBL182606 0.86 KMT2A (0.41)
SCHEMBL1199479 0.84 ALDH1A1 (0.40)
SCHEMBL12782048 0.81 LMNA (0.42)
SCHEMBL12290810 0.81 MAPT (0.37) ADRA2AADRA2BADRA2CCYP3A4DPP4
SCHEMBL18068 0.79 L3MBTL1 (0.44)
SCHEMBL15332394 0.77 HDAC4 (0.35) CYP3A4CYP19A1CYP11B1CYP11B2DGAT1
SCHEMBL17894216 0.76 PDE2A (0.44) DPP4
SCHEMBL26988622 0.75 ALOX15 (0.65) ALOX15CYP17A1CYP3A4CYP19A1CYP11B1
SCHEMBL1456796 0.74 ACACB (0.34)
SCHEMBL17235787 0.74 DPP4 (0.37) CYP3A4CYP19A1DPP4DGAT1

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
WO-2012025857-A1 CYCLOALKYL METHOXYBENZYL PHENYL PYRAN DERIVATIVES AS SODIUM DEPENDENT GLUCOSE CO TRANSPORTER (SGLT2) INHIBITORS HETERO RESEARCH FOUNDATION (IN) 2012-03-01 WO disclosed