SCHEMBL8350342

SCHEMBL8350342

COC(=O)c1sccc1NC(=O)CN1CCN(c2ccc(C(c3ccccc3)c3ccc(Cl)cc3)cc2)CC1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 9/20 0.68
▸ TSHR P16473 6/20 0.68
▸ LMNA P02545 3/20 0.68
▸ MAPK10 P53779 3/20 0.68
▸ MAPK1 P28482 2/20 0.68
▸ HSD17B10 Q99714 1/20 0.68
▸ HTR1A P08908 1/20 0.60
▸ HTR7 P34969 1/20 0.60
▸ NPSR1 Q6W5P4 2/20 0.58
▸ ALDH1A1 P00352 4/20 0.54
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ USP2 O75604 1/20 0.53
▸ DRD4 P21917 1/20 0.53
▸ CYP1A2 P05177 1/20 0.51
▸ CYP2D6 P10635 1/20 0.51
▸ CYP2C9 P11712 1/20 0.51
▸ CYP2C19 P33261 1/20 0.51
▸ KMT2A Q03164 4/20 0.49
▸ MEN1 O00255 3/20 0.49
▸ HTT P42858 2/20 0.49

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
SCHEMBL8350338 0.89 MAPT (0.55) MAPTTSHRLMNAMAPK10MAPK1
SCHEMBL8358322 0.76 TSHR (0.71) MAPTTSHRLMNAMAPK10MAPK1
SCHEMBL8358036 0.75 POLB (0.72) MAPTTSHRLMNAMAPK10MAPK1
SCHEMBL31531433 0.74 MAPK10 (0.69) MAPTTSHRLMNAMAPK10MAPK1
SCHEMBL8354074 0.74 MAPT (0.68) MAPTTSHRLMNAMAPK10MAPK1
Hydrochloric Acid SCHEMBL8351225 0.73 MAPT (0.67) MAPTTSHRLMNAMAPK10MAPK1
SCHEMBL8350645 0.73 MAPT (0.52) MAPTTSHRLMNAALDH1A1SMN1; SMN2
SCHEMBL10731084 0.72 HTR1A (0.71) MAPTTSHRLMNAMAPK10MAPK1
SCHEMBL8351821 0.69 MAPK10 (0.56) MAPTTSHRLMNAMAPK10MAPK1
SCHEMBL8356499 0.69 MAPK1 (0.61) MAPTTSHRLMNAMAPK10MAPK1

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
WO-1999031096-A1 PIPERAZINE DERIVATIVES USEFUL AS HYPOGLYCEMIC AGENTS SHAMAN PHARMACEUTICALS, INC. (US) 1999-06-24 — — WO claimed
WO-1999031096-A1 PIPERAZINE DERIVATIVES USEFUL AS HYPOGLYCEMIC AGENTS SHAMAN PHARMACEUTICALS, INC. (US) 1999-06-24 — — WO disclosed
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