SCHEMBL8040099

SCHEMBL8040099

Cc1nc2c(Cl)ccc(O)c2s1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.43
MAPT P10636 5/20 0.41
KDM4E B2RXH2 4/20 0.41
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
LMNA P02545 3/20 0.41
POLB P06746 1/20 0.41
MAPK1 P28482 2/20 0.38
HSD17B10 Q99714 1/20 0.38
HPGD P15428 2/20 0.37
ALDH1A1 P00352 2/20 0.37
TSHR P16473 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
TLR8 Q9NR97 1/20 0.36
TLR7 Q9NYK1 1/20 0.36
CYP3A4 P08684 1/20 0.34
ALOX15 P16050 1/20 0.34
BRD4 O60885 1/20 0.33
HSP90AA1 P07900 1/20 0.33

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
SCHEMBL13885581 0.84 SMN1; SMN2 (0.59) SMN1; SMN2MAPTKDM4EMEN1KMT2A
SCHEMBL20597519 0.81 SMN1; SMN2 (0.46) SMN1; SMN2MAPTKDM4EMEN1KMT2A
SCHEMBL22439175 0.79 NQO2 (0.43) SMN1; SMN2MAPTKDM4EMEN1KMT2A
SCHEMBL8057785 0.76 ALDH1A1 (0.56) SMN1; SMN2MAPTKDM4EMEN1KMT2A
SCHEMBL12584953 0.73 MEN1 (0.51) SMN1; SMN2MAPTKDM4EMEN1KMT2A
SCHEMBL8040184 0.73 CTSB (0.51) SMN1; SMN2MAPTKDM4EMEN1KMT2A
SCHEMBL21091526 0.72 NQO2 (0.43) MAPTKDM4EMEN1KMT2ALMNA
SCHEMBL30601538 0.72 NQO2 (0.43) MAPTKDM4EMEN1KMT2ALMNA
SCHEMBL30189756 0.70 ALDH1A1 (0.44) MAPTMEN1KMT2ALMNAPOLB
SCHEMBL19783365 0.70 ALDH1A1 (0.44) MAPTMEN1KMT2ALMNAPOLB

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-6130217-A ANTITUMOR PFIZER INC (US) 2000-10-10 US disclosed
WO-1994022846-A1 COMPOUNDS ENHANCING ANTITUMOR ACTIVITY OF OTHER CYTOTOXIC AGENTS PFIZER INC. (US) 1994-10-13 WO disclosed