SCHEMBL24774262

SCHEMBL24774262

COC(=O)c1cnc(Cl)cc1OC(F)F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.41
▸ PKM P14618 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ ENPP1 P22413 1/20 0.39
▸ GAA P10253 2/20 0.38
▸ MAPT P10636 2/20 0.38
▸ KCNQ3 O43525 1/20 0.38
▸ KCNQ2 O43526 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ LMNA P02545 2/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ NFKB1 P19838 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ NFKB2 Q00653 1/20 0.37
▸ RELA Q04206 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ POLQ O75417 1/20 0.37
▸ ALDH1A1 P00352 2/20 0.36
▸ NR1I2 O75469 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
SCHEMBL425641 0.83 GAA (0.53) MEN1KMT2AGAAMAPTKCNQ3
SCHEMBL30031533 0.83 GAA (0.53) MEN1KMT2AGAAMAPTKCNQ3
SCHEMBL30640105 0.81 POLQ (0.48) POLQ
SCHEMBL24769264 0.81 POLQ (0.48) POLQ
SCHEMBL31160429 0.80 ABL1 (0.38) KMT2AGAAKCNQ3KCNQ2KDM4E
SCHEMBL22717387 0.79 SMN1; SMN2 (0.43) MEN1KMT2AMAPTKDM4ESMN1; SMN2
SCHEMBL16782971 0.78 CNR2 (0.43) MAPTPOLQ
SCHEMBL29416286 0.77 KDM4E (0.49) MEN1KMT2AGAAMAPTKDM4E
SCHEMBL977733 0.77 KDM4E (0.49) MEN1KMT2AGAAMAPTKDM4E
SCHEMBL28369496 0.76 KDM4E (0.49) MEN1KMT2AGAAMAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022253327-A1 PREPARATION AND USE OF COMPOUND HAVING IMMUNOMODULATORY FUNCTION 上海轶诺药业有限公司 2022-12-08 — — WO disclosed
CN-115433210-A Preparation and application of compound with immunoregulation function 上海轶诺药业有限公司 2022-12-06 — — CN disclosed
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