SCHEMBL7945400

SCHEMBL7945400

NC(=O)c1ccc(N(S)C(=O)Nc2cccc(N)c2Cl)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.41
POLB P06746 1/20 0.41
LMNA P02545 2/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 1/20 0.36
GPR35 Q9HC97 1/20 0.35
MAPT P10636 2/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
RAB9A P51151 2/20 0.34
NPC1 O15118 1/20 0.34
HPGD P15428 1/20 0.34
HDAC1 Q13547 7/20 0.33
HDAC3 O15379 6/20 0.33
HDAC2 Q92769 4/20 0.33
NCOR2 Q9Y618 3/20 0.33
MAPK1 P28482 1/20 0.33
BCAT2 O15382 1/20 0.33
PARP1 P09874 1/20 0.33
P2RX7 Q99572 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
SCHEMBL6815400 0.88 LMNA (0.49) SMN1; SMN2POLBLMNAKDM4EALDH1A1
SCHEMBL7950460 0.87 HDAC1 (0.46) RAB9ANPC1HDAC1HDAC3HDAC2
SCHEMBL7945322 0.86 POLB (0.43) SMN1; SMN2POLBLMNAKDM4EALDH1A1
SCHEMBL6819683 0.85 SMN1; SMN2 (0.47) SMN1; SMN2POLBLMNAKDM4EALDH1A1
SCHEMBL7939065 0.84 NPC1 (0.48) SMN1; SMN2POLBLMNAMAPTMEN1
SCHEMBL6819653 0.83 KDM4E (0.48) SMN1; SMN2POLBKDM4EALDH1A1MEN1
SCHEMBL6815612 0.80 HDAC1 (0.36) SMN1; SMN2POLBKDM4EALDH1A1MAPT
SCHEMBL6814354 0.79 SMN1; SMN2 (0.47) SMN1; SMN2POLBLMNAKDM4EALDH1A1
SCHEMBL7938992 0.77 L3MBTL1 (0.44) POLBLMNAALDH1A1MAPTMEN1
SCHEMBL7666786 0.77 RAB9A (0.46) SMN1; SMN2POLBKDM4EALDH1A1MAPT

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-6262082-B1 Diaminopyridine-containing thiourea inhibitors of herpes viruses WYETH 2001-07-17 US disclosed