SCHEMBL9314754

SCHEMBL9314754

CN(C)c1ccc(C(=O)C(F)(F)c2cccc(Cl)c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.47
RAB9A P51151 3/20 0.47
NPC1 O15118 2/20 0.47
LMNA P02545 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
MEN1 O00255 1/20 0.47
TP53 P04637 1/20 0.47
TSHR P16473 1/20 0.47
NFKB1 P19838 1/20 0.47
NFKB2 Q00653 1/20 0.47
KMT2A Q03164 1/20 0.47
RELA Q04206 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
NOX1 Q9Y5S8 1/20 0.47
GRM5 P41594 1/20 0.44
ALDH1A1 P00352 5/20 0.43
TDP1 Q9NUW8 2/20 0.43
POLB P06746 2/20 0.43
HPGD P15428 3/20 0.41
KCNK3 O14649 1/20 0.39

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
SCHEMBL9771667 0.88 ACHE (0.42) MAPTRAB9ANPC1LMNAL3MBTL1
Hydrochloric Acid SCHEMBL9315815 0.86 ACHE (0.41) MAPTRAB9ANPC1LMNAL3MBTL1
SCHEMBL25007317 0.82 CES1 (0.48) RAB9ANPC1LMNAKCNK3ACHE
SCHEMBL9314765 0.82 HPGD (0.56) MAPTRAB9ANPC1MEN1KMT2A
SCHEMBL9315984 0.81 NPC1 (0.49) MAPTRAB9ANPC1LMNAL3MBTL1
SCHEMBL30222811 0.78 SMN1; SMN2 (0.49) MAPTNPC1LMNAL3MBTL1MEN1
SCHEMBL16147429 0.78 KMT2A (0.47) MAPTRAB9ANPC1L3MBTL1KMT2A
SCHEMBL25007300 0.75 CES2 (0.47) RAB9ANPC1MEN1TSHRKMT2A
SCHEMBL30222651 0.75 CES2 (0.47) RAB9ANPC1MEN1TSHRKMT2A
SCHEMBL25007318 0.72 CYP19A1 (0.55) RAB9ANPC1LMNAL3MBTL1MEN1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5006563-A Alzheimer's disease HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1991-04-09 US claimed
US-5300527-A Administering anticholinergic agents for treating the memory dysfunction HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1994-04-05 US disclosed
US-5177111-A Analgesic HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1993-01-05 US disclosed
EP-0432719-A1 Alkylamino- and alkylaminoalkyl diarylketones, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1991-06-19 EP disclosed
US-5006563-A Alzheimer's disease HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1991-04-09 US disclosed