SCHEMBL30451573

SCHEMBL30451573

Oc1nnc(Br)c2ccc(Br)cc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.38
PIM1 P11309 1/20 0.35
PLAU P00749 2/20 0.35
PDPK1 O15530 2/20 0.34
JAK2 O60674 2/20 0.34
ERN1 O75460 2/20 0.34
CASP1 P29466 2/20 0.33
ESR2 Q92731 1/20 0.33
CES2 O00748 1/20 0.33
GALR3 O60755 1/20 0.33
GAA P10253 1/20 0.33
CASP7 P55210 1/20 0.33
ALK Q9UM73 1/20 0.33
AR P10275 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
HPGD P15428 1/20 0.33
CYP2C19 P33261 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL26732579 1.00 ALOX15 (0.38) ALOX15PIM1PLAUPDPK1JAK2
SCHEMBL29426530 0.91 ALOX15 (0.38) ALOX15PIM1PLAUPDPK1JAK2
SCHEMBL26732576 0.91 ALOX15 (0.38) ALOX15PIM1PLAUPDPK1JAK2
SCHEMBL2462679 0.89 ALOX15 (0.42) ALOX15PIM1PLAUPDPK1JAK2
SCHEMBL29426543 0.86 JAK2 (0.39) ALOX15PIM1PLAUPDPK1JAK2
SCHEMBL26732575 0.86 JAK2 (0.39) ALOX15PIM1PLAUPDPK1JAK2
SCHEMBL23526025 0.79 SOS1 (0.39) ALOX15PIM1PLAUCASP1ESR2
SCHEMBL599376 0.77 IDO1 (0.36) CYP1A2HPGDCYP2C19MEN1KMT2A
SCHEMBL29426477 0.75 ALOX15 (0.35) ALOX15PIM1PLAUPDPK1JAK2
SCHEMBL24469239 0.74 POLB (0.36) ALOX15PIM1PLAUMEN1KMT2A

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
CN-116261456-A Compounds, compositions, and methods 戴纳立制药公司 2023-06-13 CN disclosed