SCHEMBL30005833

SCHEMBL30005833

O=C(Nc1ccc(S(=O)(=O)N2CCN(c3cc(Cl)cc(Cl)c3)CC2)cc1)c1ccncc1F

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.55
POLB P06746 1/20 0.52
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.49
LMNA P02545 2/20 0.48
TP53 P04637 1/20 0.48
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
ATM Q13315 1/20 0.48
TRPC1 P48995 1/20 0.48
TRPC3 Q13507 1/20 0.48
STIM1 Q13586 1/20 0.48
ORAI1 Q96D31 1/20 0.48
TRPV4 Q9HBA0 1/20 0.47
ABL1 P00519 1/20 0.47

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
SCHEMBL30006561 0.89 MEN1 (0.52) MAPTMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL30005698 0.85 MEN1 (0.48) MAPTPOLBMEN1KMT2ASMN1; SMN2
SCHEMBL30004774 0.84 ALDH1A1 (0.58) MAPTMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL30005508 0.83 KMT2A (0.49) MAPTPOLBMEN1KMT2ASMN1; SMN2
SCHEMBL30005757 0.79 MEN1 (0.51) MAPTPOLBMEN1KMT2ASMN1; SMN2
SCHEMBL30005455 0.78 TDP1 (0.52) MAPTPOLBMEN1KMT2AALDH1A1
SCHEMBL30005703 0.77 MAPT (0.47) MAPTPOLBMEN1KMT2AKDM4E
SCHEMBL30005561 0.76 TDP1 (0.49) MAPTPOLBMEN1KMT2ATP53
SCHEMBL30005953 0.76 TDP1 (0.49) MAPTPOLBMEN1KMT2AALDH1A1
SCHEMBL175270 0.75 NAMPT (0.81)

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-2022220725-A1 LPXH INHIBITORS AS ANTI-INFECTIVE AGENTS ZAMARATSKI EDOUARD (SE) 2022-10-20 WO disclosed