SCHEMBL8627056

SCHEMBL8627056

CCCCc1c(N2CCCCC2)ccc2c1C(C(=O)NCC(F)(F)C(F)(F)C(F)(F)F)c1ccccc1-2

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.39
▸ DRD2 P14416 3/20 0.35
▸ DRD4 P21917 3/20 0.35
▸ DRD3 P35462 3/20 0.35
▸ LMNA P02545 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ PSEN1 P49768 2/20 0.33
▸ PSEN2 P49810 2/20 0.33
▸ APH1B Q8WW43 2/20 0.33
▸ NCSTN Q92542 2/20 0.33
▸ APH1A Q96BI3 2/20 0.33
▸ PSENEN Q9NZ42 2/20 0.33
▸ MAPT P10636 3/20 0.32
▸ TP53 P04637 1/20 0.32
▸ NPSR1 Q6W5P4 2/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL8593680 0.91 POLB (0.42) POLBDRD2DRD4DRD3LMNA
SCHEMBL8627054 0.87 POLB (0.39) POLBDRD2DRD4DRD3LMNA
SCHEMBL8479608 0.86 NPY1R (0.36) POLBLMNAPSEN1PSEN2APH1B
SCHEMBL8480929 0.85 DRD2 (0.44) POLBDRD2DRD4DRD3LMNA
SCHEMBL8503792 0.84 POLB (0.33) POLBPSEN1PSEN2APH1BNCSTN
SCHEMBL8666699 0.83 NPY1R (0.33) POLBLMNANPSR1
SCHEMBL8487926 0.81 NPY1R (0.36) POLBLMNAPSEN1PSEN2APH1B
SCHEMBL8503703 0.79 PSEN1 (0.36) POLBLMNAPSEN1PSEN2APH1B
SCHEMBL8664248 0.78 PSEN1 (0.34) POLBLMNAPSEN1PSEN2APH1B
SCHEMBL8593675 0.78 POLB (0.41) POLBDRD2DRD4DRD3LMNA

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-0886637-A4 — — 1998-12-30 — — EP claimed
EP-0886637-A1 INHIBITORS OF MICROSOMAL TRIGLYCERIDE TRANSFER PROTEIN AND METHOD BRISTOL-MYERS SQUIBB COMPANY (US) 1998-12-30 — — EP claimed
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