SCHEMBL24710522

SCHEMBL24710522

O=C(Oc1cc(F)c(OC(=O)c2ccc3c(c2)C(=O)OC3=O)cc1F)c1ccc2c(c1)C(=O)OC2=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.43
MCL1 Q07820 1/20 0.43
CA12 O43570 6/20 0.41
CA7 P43166 5/20 0.41
CA1 P00915 4/20 0.41
CA4 P22748 2/20 0.41
SLC2A1 P11166 1/20 0.40
SLC2A4 P14672 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
NPC1 O15118 1/20 0.39
LMNA P02545 1/20 0.39
HTT P42858 1/20 0.39
RAB9A P51151 1/20 0.39
CA2 P00918 2/20 0.39
CA9 Q16790 2/20 0.39
SERPINE1 P05121 1/20 0.38
TYMS P04818 2/20 0.38
KMT2A Q03164 1/20 0.36
KDM4E B2RXH2 1/20 0.35
CYP1A2 P05177 1/20 0.35

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
SCHEMBL1627883 0.86 SERPINE1 (0.49) MAPTCA12CA7CA1CA4
SCHEMBL29366009 0.86 SERPINE1 (0.49) MAPTCA12CA7CA1CA4
SCHEMBL24710518 0.83 CA12 (0.42) MAPTMCL1CA12CA7CA1
SCHEMBL24949033 0.83 CA12 (0.45) MAPTCA12CA7CA1CA4
SCHEMBL25966157 0.82 TYMS (0.48) MAPTCA12CA7CA1CA4
SCHEMBL1608672 0.81 CA2 (0.47) MAPTCA12CA7CA1CA4
SCHEMBL30693355 0.81 CA2 (0.47) MAPTCA12CA7CA1CA4
SCHEMBL29363037 0.81 CA2 (0.47) MAPTCA12CA7CA1CA4
SCHEMBL23039676 0.80 PARP10 (0.47) MAPTCA12CA7CA1CA4
SCHEMBL4598444 0.80 KMT2A (0.47) MAPTCA12CA7CA1CA4

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-2022261654-A1 OPTICALLY TRANSPARENT POLYIMIDE ZYMERGEN INC. (US) 2022-12-15 WO disclosed