SCHEMBL11719983

SCHEMBL11719983

CS(=O)(=O)c1ccc(-n2cnnn2)cc1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.58
MAPK1 P28482 1/20 0.58
KCNJ1 P48048 2/20 0.57
NOTUM Q6P988 3/20 0.55
ALDH1A1 P00352 3/20 0.55
MAPT P10636 2/20 0.55
F2 P00734 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
LMNA P02545 2/20 0.54
HTT P42858 1/20 0.54
POLB P06746 1/20 0.54
RECQL P46063 1/20 0.52

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
SCHEMBL11715706 0.86 MAPT (0.56) KDM4EMAPK1KCNJ1NOTUMALDH1A1
SCHEMBL14919144 0.84 NOTUM (0.61) KDM4EMAPK1KCNJ1NOTUMALDH1A1
SCHEMBL13601328 0.83 KDM4E (0.63) KDM4EMAPK1KCNJ1NOTUMALDH1A1
SCHEMBL18109146 0.82 LMNA (0.67) KDM4EMAPK1KCNJ1NOTUMALDH1A1
SCHEMBL13597692 0.81 KDM4E (0.55) KDM4EMAPK1KCNJ1NOTUMALDH1A1
SCHEMBL11710804 0.80 KDM4E (0.60) KDM4EMAPK1KCNJ1NOTUMALDH1A1
SCHEMBL12615985 0.80 NOTUM (0.78) KCNJ1NOTUMALDH1A1MAPTF2
Dimethyl Sulfone SCHEMBL20720495 0.80 NOTUM (0.78) KDM4EMAPK1KCNJ1NOTUMALDH1A1
SCHEMBL11711923 0.78 KDM4E (0.55) KDM4EMAPK1KCNJ1NOTUMALDH1A1
SCHEMBL11744377 0.78 KDM4E (0.55) KDM4EMAPK1KCNJ1NOTUMALDH1A1

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
US-4036849-A ANTIMICROBIAL AMERICAN CYANAMID COMPANY (US) 1977-07-19 US claimed
US-4036849-A ANTIMICROBIAL AMERICAN CYANAMID COMPANY (US) 1977-07-19 US disclosed