SCHEMBL9314770

SCHEMBL9314770

CN(C)c1cccc(CC(=O)Cc2cccc(Cl)c2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNQ2 O43526 1/20 0.52
CNR1 P21554 1/20 0.49
CTBP2 P56545 1/20 0.49
TAAR1 Q96RJ0 1/20 0.46
HTR3E A5X5Y0 1/20 0.46
HTR3B O95264 1/20 0.46
HTR3A P46098 1/20 0.46
HTR3D Q70Z44 1/20 0.46
HTR3C Q8WXA8 1/20 0.46
ALOX5 P09917 1/20 0.46
RIPK1 Q13546 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
PIK3CA P42336 1/20 0.46
KMT2A Q03164 3/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
MEN1 O00255 2/20 0.44
NPC1 O15118 1/20 0.44
LMNA P02545 1/20 0.44
TP53 P04637 1/20 0.44

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
SCHEMBL11172110 0.85 CTBP2 (0.62) KCNQ2CTBP2TAAR1HTR3EHTR3B
SCHEMBL9316487 0.84 ALOX5 (0.47) KCNQ2ALOX5KMT2AMAPTALDH1A1
SCHEMBL9771702 0.84 RAF1 (0.52) KCNQ2CNR1CTBP2TAAR1HTR3E
Hydrochloric Acid SCHEMBL9314791 0.82 RAF1 (0.51) KCNQ2CNR1CTBP2TAAR1HTR3E
SCHEMBL5954217 0.81 TAAR1 (0.53) KCNQ2CTBP2TAAR1HTR3EHTR3B
SCHEMBL9315539 0.79 MAPT (0.52) KCNQ2CTBP2TAAR1HTR3EHTR3B
SCHEMBL2553049 0.78 KMT2A (0.54) CNR1HDAC1HDAC6KMT2AL3MBTL1
SCHEMBL7144102 0.78 CTBP2 (0.56) KCNQ2CTBP2HTR3EHTR3BHTR3A
SCHEMBL3825118 0.78 HDAC1 (0.51) CNR1HDAC1HDAC6KMT2AL3MBTL1
SCHEMBL11178925 0.78 CTBP2 (0.56) CNR1CTBP2HTR3EHTR3BHTR3A

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