SCHEMBL26683121

SCHEMBL26683121

C=CCOC(=O)c1ccc(N2CCN(Cc3cc(OC(F)(F)F)cc(-c4cncc(O)c4)c3)CC2)cc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ DRD2 P14416 2/20 0.41
▸ DRD4 P21917 2/20 0.41
▸ DRD3 P35462 2/20 0.41
▸ CHRM4 P08173 5/20 0.36
▸ LMNA P02545 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ PPARD Q03181 3/20 0.35
▸ PPARA Q07869 3/20 0.35
▸ ITGB3 P05106 1/20 0.35
▸ ITGA2B P08514 1/20 0.35
▸ CHRM2 P08172 1/20 0.35
▸ SSTR5 P35346 1/20 0.35
▸ STAT3 P40763 1/20 0.34
▸ NAMPT P43490 1/20 0.34
▸ RIPK1 Q13546 1/20 0.34

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
SCHEMBL26681869 0.90 MEN1 (0.44) MEN1KMT2ADRD2DRD4DRD3
SCHEMBL26680397 0.89 MEN1 (0.43) MEN1KMT2ADRD2DRD4DRD3
SCHEMBL26681372 0.89 KMT2A (0.45) MEN1KMT2ADRD2DRD4DRD3
SCHEMBL26680663 0.89 MEN1 (0.42) MEN1KMT2ADRD2DRD3CHRM4
SCHEMBL26680403 0.88 DRD2 (0.45) DRD2DRD4DRD3CHRM4PPARD
SCHEMBL26681657 0.83 DRD2 (0.41) DRD2DRD4DRD3CHRM4PPARD
SCHEMBL30687784 0.82 CHRM2 (0.42) DRD2DRD4DRD3CHRM4PPARD
SCHEMBL26682169 0.82 CHEK1 (0.45) DRD2DRD4DRD3CHRM4PPARD
SCHEMBL26680994 0.82 CHRM2 (0.42) DRD2DRD4DRD3CHRM4PPARD
SCHEMBL26682182 0.81 MEN1 (0.43) MEN1KMT2ADRD2DRD4DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4279476-A1 METHOD FOR ALKYLATING ACIDIC FUNCTIONAL GROUP CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2023-11-22 — — EP disclosed
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