SCHEMBL8312415

SCHEMBL8312415

Nc1c(F)cc(Cl)c2nc(Br)sc12

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.37
ALDH1A1 P00352 2/20 0.35
LMNA P02545 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
POLB P06746 1/20 0.32
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 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
SCHEMBL9148367 0.84 SMN1; SMN2 (0.38) SMN1; SMN2ALDH1A1LMNAKDM4EMEN1
Hydrochloric Acid SCHEMBL9147162 0.83 SMN1; SMN2 (0.37) SMN1; SMN2ALDH1A1LMNAKDM4EMEN1
SCHEMBL8334566 0.81 TLR8 (0.36) SMN1; SMN2ALDH1A1LMNAKDM4EMEN1
SCHEMBL8329490 0.78 TLR8 (0.40) SMN1; SMN2ALDH1A1
SCHEMBL8310400 0.78 MAPT (0.36) SMN1; SMN2ALDH1A1LMNAKDM4EMEN1
SCHEMBL8331898 0.78 KDR (0.36) SMN1; SMN2ALDH1A1
SCHEMBL8333788 0.75 SMN1; SMN2 (0.32) SMN1; SMN2ALDH1A1
SCHEMBL8312356 0.74 ALDH1A1 (0.58) SMN1; SMN2ALDH1A1LMNAKDM4EMEN1
SCHEMBL8554380 0.73 SMN1; SMN2 (0.30) SMN1; SMN2
SCHEMBL8310374 0.73 ALDH1A1 (0.39) SMN1; SMN2ALDH1A1LMNAMEN1POLB

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
EP-0958295-A1 SUBSTITUTED 2-(2,4(1H,3H)-PYRIMIDINDION-3-YL) BENZTHIAZOLES BASF AKTIENGESELLSCHAFT (DE) 1999-11-24 EP disclosed
WO-1998033796-A1 SUBSTITUTED 2-(2,4(1H,3H)-PYRIMIDINDION-3-YL) BENZTHIAZOLES BASF AKTIENGESELLSCHAFT (DE) 1998-08-06 WO disclosed