SCHEMBL7770801

SCHEMBL7770801

O=C(CCl)COc1ccc(-c2ccccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.55
NPC1 O15118 3/20 0.55
RAB9A P51151 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
LMNA P02545 3/20 0.54
ALDH1A1 P00352 3/20 0.54
CASP3 P42574 1/20 0.54
SENP8 Q96LD8 1/20 0.54
SENP7 Q9BQF6 1/20 0.54
SENP6 Q9GZR1 1/20 0.54
PPARG P37231 1/20 0.50
PPARD Q03181 1/20 0.50
ALOX15 P16050 1/20 0.50
MMP3 P08254 1/20 0.49
FAAH O00519 1/20 0.48
BCHE P06276 1/20 0.48
ACHE P22303 1/20 0.48
POLB P06746 1/20 0.48
KMT2A Q03164 1/20 0.48
CTDSP1 Q9GZU7 1/20 0.48

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
SCHEMBL4125546 0.89 ALOX15 (0.63) MAPTNPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL2324869 0.81 MAPT (0.58) MAPTNPC1RAB9ASMN1; SMN2LMNA
SCHEMBL422442 0.81 ALOX15 (0.76) MAPTNPC1RAB9ASMN1; SMN2LMNA
SCHEMBL9362459 0.79 MAPT (0.55) MAPTNPC1RAB9ASMN1; SMN2LMNA
SCHEMBL11732430 0.78 POLB (0.51) MAPTSMN1; SMN2ALDH1A1POLBKMT2A
SCHEMBL7733929 0.78 MAPT (0.66) MAPTNPC1RAB9ASMN1; SMN2LMNA
SCHEMBL5057157 0.78 ACACA (0.61) MAPTNPC1RAB9ASMN1; SMN2LMNA
SCHEMBL1311321 0.76 MAPT (0.79) MAPTNPC1RAB9ASMN1; SMN2LMNA
SCHEMBL3898377 0.76 ALOX15 (0.74) MAPTNPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL6163614 0.75 MAPT (0.69) MAPTNPC1RAB9ASMN1; SMN2LMNA

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-1114029-A1 NOVEL COMPOUNDS AstraZeneca AB (SE) 2001-07-11 EP disclosed
WO-2000015614-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2000-03-23 WO disclosed