SCHEMBL8370002

SCHEMBL8370002

COc1ccc(-c2cc(C(=O)Cl)n(Cc3ccc(C)c(Cl)c3)n2)cc1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.59
SMN1; SMN2 Q16637 4/20 0.46
TDP1 Q9NUW8 1/20 0.46
POLB P06746 2/20 0.46
NPBWR1 P48145 1/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
ASIC1 P78348 1/20 0.42
HDAC1 Q13547 1/20 0.42
MARS1 P56192 1/20 0.41
LMNA P02545 3/20 0.41
TP53 P04637 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HTT P42858 1/20 0.41

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
SCHEMBL8368086 0.92 MAPT (0.61) MAPTSMN1; SMN2TDP1POLBNPBWR1
SCHEMBL8369223 0.91 MAPT (0.63) MAPTSMN1; SMN2TDP1POLBNPBWR1
SCHEMBL8369096 0.91 MAPT (0.58) MAPTSMN1; SMN2TDP1POLBNPBWR1
Hydrochloric Acid SCHEMBL8370004 0.91 MAPT (0.60) MAPTSMN1; SMN2TDP1POLBNPBWR1
SCHEMBL8369156 0.82 NPBWR1 (0.46) MAPTSMN1; SMN2NPBWR1MEN1KMT2A
SCHEMBL13425922 0.78 MAPT (0.69) MAPTSMN1; SMN2TDP1POLBMEN1
SCHEMBL8369155 0.77 RPA1 (0.54) NPBWR1MARS1ALDH1A1
SCHEMBL8366718 0.77 SMN1; SMN2 (0.54) MAPTSMN1; SMN2TDP1POLBMEN1
SCHEMBL8042554 0.77 CNR2 (0.58) MAPT
Hydrochloric Acid SCHEMBL8369158 0.77 RPA1 (0.53) NPBWR1MARS1ALDH1A1

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-5925768-A ANTIINFLAMMATORY AGENTS; ANALGESICS, ANTICOAGULANTS, NARCOTICS SANOFI (FR) 1999-07-20 US disclosed