SCHEMBL8957656

SCHEMBL8957656

CCC(N)N1CCN(c2cccc(Cl)c2)CC1

nearest known ligand 0.72

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.55
ALDH1A1 P00352 1/20 0.55
MAPT P10636 1/20 0.55
ALOX12 P18054 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
TSHR P16473 1/20 0.54
MAPK1 P28482 1/20 0.54
RECQL P46063 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
HTR1A P08908 1/20 0.52
HTR2A P28223 1/20 0.52
HTR7 P34969 1/20 0.52
HTR6 P50406 1/20 0.52
KCNH2 Q12809 1/20 0.52
HTR3E A5X5Y0 1/20 0.51
HTR3B O95264 1/20 0.51
HTR3A P46098 1/20 0.51
HTR3D Q70Z44 1/20 0.51
HTR3C Q8WXA8 1/20 0.51

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
SCHEMBL4255355 0.83 ALDH1A1 (0.59) LMNAALDH1A1MAPTALOX12SMN1; SMN2
SCHEMBL8686716 0.83 LMNA (0.52) LMNAALDH1A1MAPTALOX12SMN1; SMN2
SCHEMBL30767206 0.82 TSHR (0.57) LMNAALDH1A1MAPTTSHRMAPK1
Hydrochloric Acid SCHEMBL10372885 0.82 LMNA (0.54) LMNAALDH1A1MAPTALOX12SMN1; SMN2
SCHEMBL29204363 0.82 TSHR (0.57) LMNAALDH1A1MAPTTSHRMAPK1
SCHEMBL11955707 0.80 HTR3E (0.58) LMNAALDH1A1MAPTALOX12SMN1; SMN2
SCHEMBL6714846 0.79 ALDH1A1 (0.75) LMNAALDH1A1MAPTALOX12SMN1; SMN2
SCHEMBL11100857 0.79 ALDH1A1 (0.75) LMNAALDH1A1MAPTALOX12SMN1; SMN2
SCHEMBL8128745 0.78 HTR3E (0.53) HTR1AHTR2AHTR7HTR6KCNH2
SCHEMBL10758263 0.78 LMNA (0.53) LMNAALDH1A1MAPTALOX12SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0343961-B1 Aryl- and heteroaryl piperazinyl carboxamides having central nervous system activity AMERICAN HOME PROD (US) 1996-01-10 EP disclosed
US-5482940-A OBESITY, ALCOHOLISM AMERICAN HOME PRODUCTS CORPORATION (US) 1996-01-09 US disclosed
US-5380725-A Antipsychotic agents and anxiolytic agents AMERICAN HOME PRODUCTS CORPORATION (US) 1995-01-10 US disclosed
US-5278160-A Treating aggressive behavior AMERICAN HOME PRODUCTS CORPORATION (US) 1994-01-11 US disclosed
US-5254552-A Cognition activators, psychological disorders AMERICAN HOME PRODUCTS CORPORATION (US) 1993-10-19 US disclosed
US-5106849-A Treating anxiety, depression, psychoses AMERICAN HOME PRODUCTS CORPORATION (US) 1992-04-21 US disclosed
US-5010078-A Anxiolytic, antidepressant agents AMERICAN HOME PRODUCTS CORPORATION (US) 1991-04-23 US disclosed