SCHEMBL9407932

SCHEMBL9407932

Cc1ccc(S(=O)(=O)N(C(=O)Oc2c3ccccc3nc3ccccc23)c2ccc(CCC(=O)ON3C(=O)CCC3=O)cc2)cc1.O=S(=O)(O)F

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.35
KDM4E B2RXH2 2/20 0.35
CA2 P00918 3/20 0.33
TP53 P04637 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ALDH1A1 P00352 5/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA9 Q16790 1/20 0.33
C1R P00736 1/20 0.33
PRSS1 P07477 1/20 0.33
PSMB8 P28062 1/20 0.32
PSMB5 P28074 1/20 0.32
MAPT P10636 5/20 0.32
THRB P10828 1/20 0.32
PKM P14618 1/20 0.32
HPGD P15428 1/20 0.32
HTT P42858 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32

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
SCHEMBL8079566 0.97 LMNA (0.37) LMNAKDM4ECA2TP53SMN1; SMN2
SCHEMBL8080908 0.90 LMNA (0.39) LMNAKDM4ETP53SMN1; SMN2ALDH1A1
SCHEMBL8074300 0.89 ALDH1A1 (0.40) LMNAKDM4ECA2TP53SMN1; SMN2
SCHEMBL8469910 0.86 LMNA (0.38) LMNAKDM4ECA2TP53ALDH1A1
SCHEMBL8074297 0.84 TSHR (0.40) LMNACA2TP53SMN1; SMN2ALDH1A1
SCHEMBL8079548 0.84 ALDH1A1 (0.38) LMNAKDM4ECA2TP53SMN1; SMN2
SCHEMBL9407920 0.84 CXCR3 (0.34) LMNAKDM4ECA2TP53SMN1; SMN2
SCHEMBL8074295 0.83 MAPT (0.40) LMNAKDM4ETP53SMN1; SMN2ALDH1A1
Bromide SCHEMBL8076253 0.82 ALDH1A1 (0.42) LMNAKDM4ETP53SMN1; SMN2ALDH1A1
SCHEMBL8066369 0.82 TP53 (0.33) LMNAKDM4ETP53SMN1; SMN2ALDH1A1

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
EP-0602524-A1 Chemiluminescence marked sequences and their use in sequence testing HOECHST AKTIENGESELLSCHAFT (DE) 1994-06-22 EP disclosed