SCHEMBL7476763

SCHEMBL7476763

Cc1cc(C)c(NC(=O)CN2CCC(c3ccc(Cc4ccc(F)cc4)cc3)CC2)c(C)c1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.54
RAB9A P51151 2/20 0.54
MEN1 O00255 1/20 0.54
POLB P06746 1/20 0.54
KMT2A Q03164 1/20 0.54
DRD4 P21917 11/20 0.53
DRD2 P14416 3/20 0.53
DRD3 P35462 3/20 0.53
ALOX15 P16050 1/20 0.53
ALDH1A1 P00352 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
LMNA P02545 1/20 0.47
TSHR P16473 1/20 0.47
MAPT P10636 1/20 0.44
KCNQ2 O43526 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
SCHEMBL7465897 0.88 DRD2 (0.49) NPC1RAB9AMEN1KMT2ADRD4
SCHEMBL7476441 0.81 LMNA (0.64) DRD4DRD2DRD3ALDH1A1SMN1; SMN2
SCHEMBL7470536 0.78 KDM4E (0.58) NPC1RAB9AMEN1POLBKMT2A
SCHEMBL7423903 0.74 ALOX15 (0.60) NPC1RAB9AMEN1POLBKMT2A
SCHEMBL7478660 0.73 DRD4 (0.63) MEN1KMT2ADRD4DRD2DRD3
SCHEMBL7465842 0.72 DRD4 (0.46) MEN1KMT2ADRD4DRD2DRD3
SCHEMBL8216077 0.72 DRD2 (0.59) KMT2ADRD2ALDH1A1LMNA
SCHEMBL17731134 0.72 DRD4 (0.67) NPC1DRD4DRD2DRD3ALDH1A1
SCHEMBL3893619 0.71 SMN1; SMN2 (0.61) MEN1POLBKMT2ADRD4DRD2
SCHEMBL3903652 0.71 DRD4 (0.54) MEN1KMT2ADRD4DRD2DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0757986-B1 Arylpiperidine and arylpiperazine derivatives and drugs containing the same SUNTORY LTD (JP) 2002-06-12 EP disclosed
US-5723475-A Arylpiperidine and arylpiperazine derivatives and medicament containing the same SUNTORY LIMITED (JP) 1998-03-03 US disclosed
EP-0757986-A1 ARYLPIPERIDINE AND ARYLPIPERAZINE DERIVATIVES AND DRUGS CONTAINING THE SAME SUNTORY LIMITED (JP) 1997-02-12 EP disclosed