SCHEMBL30360703

SCHEMBL30360703

OCCc1cc(Cl)ccc1Br

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.42
HIF1A Q16665 3/20 0.42
MEN1 O00255 3/20 0.42
HPGD P15428 3/20 0.42
KMT2A Q03164 3/20 0.42
IDO1 P14902 3/20 0.42
MAPT P10636 3/20 0.42
ALOX15 P16050 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
HTT P42858 2/20 0.42
SLC22A1 O15245 1/20 0.42
USP2 O75604 1/20 0.42
LMNA P02545 1/20 0.42
HSP90AA1 P07900 1/20 0.42
HSPD1 P10809 1/20 0.42
HSPA5 P11021 1/20 0.42
ALOX12 P18054 1/20 0.42
CASP1 P29466 1/20 0.42
BLM P54132 1/20 0.42
HSPE1 P61604 1/20 0.42

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
SCHEMBL3657647 1.00 CYP3A4 (0.42) CYP3A4HIF1AMEN1HPGDKMT2A
SCHEMBL924319 0.88 HIF1A (0.39) CYP3A4HIF1AMEN1HPGDKMT2A
SCHEMBL29381205 0.88 HIF1A (0.39) CYP3A4HIF1AMEN1HPGDKMT2A
SCHEMBL2560634 0.87 NOS3 (0.44) CYP3A4HIF1AMEN1HPGDKMT2A
SCHEMBL3634811 0.83 PYCR1 (0.44) CYP3A4HIF1AMEN1HPGDKMT2A
SCHEMBL500015 0.83 CYP3A4 (0.45) CYP3A4HIF1AMEN1HPGDKMT2A
SCHEMBL12713145 0.81 NOS3 (0.41) CYP3A4HIF1AMEN1HPGDKMT2A
SCHEMBL4967338 0.81 NOS3 (0.41) CYP3A4HIF1AMEN1HPGDKMT2A
SCHEMBL16268636 0.79 TAAR1 (0.52) CYP3A4HIF1AMEN1HPGDKMT2A
SCHEMBL29960836 0.79 TAAR1 (0.52) CYP3A4HIF1AMEN1HPGDKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116514761-A Compounds, compositions and uses thereof 赛诺维信制药公司 2023-08-01 CN disclosed
CN-116283877-A Compounds, compositions and uses thereof 赛诺维信制药公司 2023-06-23 CN disclosed
CN-110088107-B Compounds, compositions and uses thereof 赛诺维信制药公司 2023-04-14 CN disclosed