SCHEMBL13898537

SCHEMBL13898537

O=C(CN1CCC(O)(c2ccc(Cc3ccc(F)cc3)cc2)CC1)NC1CC1c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.57
TSHR P16473 1/20 0.50
DRD2 P14416 3/20 0.43
KDM1A O60341 6/20 0.43
TLR2 O60603 2/20 0.43
TLR1 Q15399 2/20 0.43
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42

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
SCHEMBL3896702 1.00 LMNA (0.58) LMNASMN1; SMN2TSHRDRD2KDM1A
SCHEMBL7465842 0.83 DRD4 (0.46) DRD2KDM1ATLR2TLR1MAOA
SCHEMBL13898533 0.83 LMNA (0.48) LMNASMN1; SMN2KDM1AMAOBKDM4E
SCHEMBL3902533 0.79 SMN1; SMN2 (0.62) LMNASMN1; SMN2TSHRDRD2KDM4E
SCHEMBL3900031 0.79 DRD2 (0.56) SMN1; SMN2DRD2
SCHEMBL3900030 0.79 DRD2 (0.56) SMN1; SMN2DRD2
SCHEMBL3888734 0.77 DRD2 (0.60) SMN1; SMN2TSHRDRD2
SCHEMBL3893619 0.74 SMN1; SMN2 (0.61) LMNASMN1; SMN2TSHRDRD2KDM4E
SCHEMBL3891434 0.73 OPRL1 (0.71) SMN1; SMN2DRD2ALDH1A1
SCHEMBL17001402 0.71 KDM1A (0.72) KDM1AMAOAMAOB

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
US-7498344-B2 Arylpiperidinol and arylpiperidine derivatives and pharmaceuticals containing the same ASUBIO PHARMA CO., LTD. (JP) 2009-03-03 US disclosed
US-7498344-B2 Arylpiperidinol and arylpiperidine derivatives and pharmaceuticals containing the same ASUBIO PHARMA CO., LTD. (JP) 2009-03-03 US disclosed