SCHEMBL27344324

SCHEMBL27344324

O=C(Nc1ccccc1Cl)c1[nH]c2ccc(Cl)cc2c1CN1CCOCC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.56
HSD17B10 Q99714 2/20 0.56
MAPT P10636 2/20 0.56
GAA P10253 2/20 0.56
ALOX15 P16050 1/20 0.56
ALDH1A1 P00352 1/20 0.49
HPGD P15428 1/20 0.49
HTT P42858 1/20 0.48
CNR1 P21554 3/20 0.47
NHERF1 O14745 1/20 0.46
POLB P06746 3/20 0.45
EGFR P00533 1/20 0.44
CDK2 P24941 1/20 0.44
PKM P14618 1/20 0.43
LMNA P02545 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MAP2 P11137 1/20 0.43
MCL1 Q07820 1/20 0.42
F10 P00742 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
SCHEMBL27344320 0.92 MCL1 (0.49) KDM4EHSD17B10MAPTGAAALOX15
SCHEMBL27348988 0.85 ROCK2 (0.42) KDM4EHSD17B10MAPTGAAALOX15
SCHEMBL27344318 0.85 KDM4E (0.49) KDM4EMAPTGAAHTTPOLB
SCHEMBL27344298 0.84 CDK2 (0.43) KDM4EHSD17B10MAPTGAAALOX15
SCHEMBL27344207 0.83 POLB (0.50) KDM4EGAAPOLBEGFRCDK2
SCHEMBL30702708 0.82 HTT (0.42) KDM4EHSD17B10MAPTGAAALOX15
SCHEMBL30702710 0.82 HTT (0.42) KDM4EHSD17B10MAPTGAAALOX15
SCHEMBL27347554 0.82 GAA (0.48) KDM4EMAPTGAAALDH1A1HPGD
SCHEMBL27344204 0.81 ROCK2 (0.42) KDM4EHSD17B10MAPTGAAALOX15
SCHEMBL30702704 0.81 SMN1; SMN2 (0.44) KDM4EHSD17B10MAPTGAAALDH1A1

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-2024011294-A1 ANTI-GIARDIAL COMPOUNDS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2024-01-18 WO disclosed