SCHEMBL7690664

SCHEMBL7690664

N#Cc1ccc2c(c1)CC[C@H](Cc1ccccc1)NN2

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PSEN1 P49768 1/20 0.43
▸ PSEN2 P49810 1/20 0.43
▸ APH1B Q8WW43 1/20 0.43
▸ NCSTN Q92542 1/20 0.43
▸ APH1A Q96BI3 1/20 0.43
▸ PSENEN Q9NZ42 1/20 0.43
▸ DRD2 P14416 1/20 0.41
▸ DRD3 P35462 1/20 0.41
▸ SLC6A4 P31645 2/20 0.38
▸ POLB P06746 1/20 0.38
▸ FNTA P49354 5/20 0.36
▸ FNTB P49356 5/20 0.36
▸ PNMT P11086 3/20 0.35
▸ MGLL Q99685 1/20 0.35

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
SCHEMBL7691593 0.81 POLB (0.37) SLC6A4POLBFNTAFNTB
SCHEMBL6615192 0.72 MEN1 (0.64) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL5754082 0.72 MEN1 (0.64) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL10684249 0.68 MTNR1A (0.50) POLB
SCHEMBL3105852 0.66 DRD2 (0.53) DRD2DRD3MGLL
SCHEMBL3111835 0.64 DRD2 (0.47) DRD2DRD3MGLL
SCHEMBL13737898 0.63 SLC22A1 (0.55) DRD2DRD3
SCHEMBL1725458 0.63 DRD2 (0.50) DRD2DRD3SLC6A4PNMT
SCHEMBL288540 0.63 DRD2 (0.55) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL19512772 0.62 PNMT (0.49) PSEN1PSEN2APH1BNCSTNAPH1A

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-6458783-B1 INHIBITION OF FARNESYL TRANSFERASE, WHICH IS AN ENZYME INVOLVED IN RAS ONCOGENE EXPRESSION, IS EFFECTED BY COMPOUNDS OF THE FORMULAS OF BENODIAZEPINE DERIVATIVES BRISTOL-MYERS SQUIBB COMPANY 2002-10-01 — — US disclosed
WO-2001081322-A1 NON-IMIDAZOLE BENZODIAZEPINE INHIBITORS OF FARNESYL PROTEIN TRANSFERASE BRISTOL-MYERS SQUIBB COMPANY (US) 2001-11-01 — — WO disclosed
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