SCHEMBL6186877

SCHEMBL6186877

CC(C)c1cccc(-c2ccc(C(=O)Nc3ccc(N4CCOCC4)cc3)cn2)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.62
▸ ALDH1A1 P00352 1/20 0.62
▸ MAPT P10636 4/20 0.58
▸ TP53 P04637 2/20 0.53
▸ SMN1; SMN2 Q16637 2/20 0.53
▸ PSEN1 P49768 4/20 0.53
▸ PSEN2 P49810 4/20 0.53
▸ APH1B Q8WW43 4/20 0.53
▸ NCSTN Q92542 4/20 0.53
▸ APH1A Q96BI3 4/20 0.53
▸ PSENEN Q9NZ42 4/20 0.53
▸ MCHR1 Q99705 1/20 0.52
▸ RAB9A P51151 3/20 0.52
▸ NPC1 O15118 2/20 0.52
▸ ATM Q13315 1/20 0.52
▸ PKM P14618 1/20 0.52
▸ MAPK1 P28482 1/20 0.52
▸ HTT P42858 1/20 0.51
▸ DGAT1 O75907 1/20 0.51
▸ WNT3A P56704 2/20 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
SCHEMBL5934197 0.88 ALDH1A1 (0.74) LMNAALDH1A1MAPTTP53SMN1; SMN2
SCHEMBL5934542 0.87 MAPT (0.61) LMNAALDH1A1MAPTTP53SMN1; SMN2
SCHEMBL5934501 0.85 MAPT (0.68) LMNAMAPTTP53SMN1; SMN2MCHR1
SCHEMBL5934251 0.85 RAB9A (0.55) LMNAALDH1A1MAPTTP53SMN1; SMN2
SCHEMBL30277601 0.83 ALDH1A1 (0.74) LMNAALDH1A1MAPTTP53SMN1; SMN2
SCHEMBL5934266 0.82 MAPT (0.62) LMNAALDH1A1MAPTTP53SMN1; SMN2
SCHEMBL5934510 0.82 MAPT (0.64) LMNAALDH1A1MAPTTP53SMN1; SMN2
SCHEMBL5934079 0.82 P4HTM (0.50) LMNAALDH1A1MAPTTP53SMN1; SMN2
SCHEMBL5934586 0.82 ALDH1A1 (0.61) LMNAALDH1A1MAPTTP53RAB9A
SCHEMBL5934632 0.81 TP53 (0.55) ALDH1A1MAPTTP53SMN1; SMN2RAB9A

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-1575918-A2 SUBSTITUTED BIARYL-4-CARBOXYLIC ACID ARYLAMIDE ANALOGUES AS CAPSAICIN RECEPTOR MODULATORS NEUROGEN CORPORATION (US) 2005-09-21 — — EP claimed
WO-2004056774-A2 SUBSTITUTED BIPHENYL-4-CARBOXYLIC ACID ARYLAMIDE ANALOGUES AS CAPSAICIN RECEPTOR MODULATORS NEUROGEN CORPORATION (US) 2004-07-08 — — WO claimed
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