SCHEMBL8557399

SCHEMBL8557399

O=S(=O)(Nc1oc(Cc2ccccc2)nc1-c1ccccc1Cl)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.49
ALDH1A1 P00352 3/20 0.49
LMNA P02545 3/20 0.47
NAT1 P18440 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C19 P33261 1/20 0.43
GAA P10253 3/20 0.42
TSHR P16473 1/20 0.42
HTT P42858 1/20 0.42
SLC40A1 Q9NP59 3/20 0.41
EDNRB P24530 1/20 0.41
EDNRA P25101 1/20 0.41
PGR P06401 1/20 0.39
LIMK2 P53671 2/20 0.39
NR4A2 P43354 2/20 0.39
KMT2A Q03164 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
RXRA P19793 1/20 0.39
RXRB P28702 1/20 0.39

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
SCHEMBL8556381 0.90 ALDH1A1 (0.47) MAPTALDH1A1LMNANAT1CYP1A2
SCHEMBL8560073 0.89 ALDH1A1 (0.50) MAPTALDH1A1LMNAGAATSHR
SCHEMBL8556399 0.89 MAPT (0.49) MAPTALDH1A1LMNACYP1A2CYP2D6
SCHEMBL8559381 0.89 ALDH1A1 (0.49) MAPTALDH1A1LMNASLC40A1PGR
SCHEMBL8555983 0.88 ALDH1A1 (0.45) MAPTALDH1A1LMNANAT1CYP1A2
SCHEMBL8555963 0.87 ALDH1A1 (0.47) MAPTALDH1A1LMNATSHRSLC40A1
SCHEMBL8560513 0.86 MAPT (0.49) MAPTALDH1A1LMNAGAASLC40A1
SCHEMBL8558680 0.86 ALDH1A1 (0.52) MAPTALDH1A1LMNATSHRSLC40A1
SCHEMBL8554218 0.85 ALDH1A1 (0.44) MAPTALDH1A1LMNATSHRSLC40A1
SCHEMBL8554061 0.84 ALDH1A1 (0.48) MAPTALDH1A1LMNAGAATSHR

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
US-5719163-A ARTHRITIS G.D. SEARLE & CO. (US) 1998-02-17 US disclosed