SCHEMBL31592849

SCHEMBL31592849

Clc1cc2nc(-c3cccc(CN4CCN(c5ccccc5)CC4)c3)[nH]c2cc1Cl

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 3/20 0.56
▸ HTR1A P08908 1/20 0.56
▸ HTR2A P28223 1/20 0.56
▸ SLC2A1 P11166 2/20 0.51
▸ DRD4 P21917 5/20 0.50
▸ MAPT P10636 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ ESR1 P03372 1/20 0.48
▸ PRCP P42785 3/20 0.48
▸ LMNA P02545 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ DRD3 P35462 2/20 0.46
▸ KDM4E B2RXH2 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ ACHE P22303 2/20 0.45
▸ BCHE P06276 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
SCHEMBL27040149 1.00 DRD2 (0.56) DRD2HTR1AHTR2ASLC2A1DRD4
SCHEMBL23709610 0.78 ALDH1A1 (0.61) MAPTKMT2AMEN1SMN1; SMN2KDM4E
SCHEMBL4712505 0.76 SLC2A1 (0.53) DRD2HTR1ASLC2A1
SCHEMBL19137934 0.76 ACHE (0.69) DRD2HTR1AHTR2AMAPTKMT2A
SCHEMBL7498974 0.75 DRD4 (0.72) DRD2HTR1ADRD4DRD3
SCHEMBL20766948 0.75 POLB (0.55) DRD2HTR1AHTR2ASLC2A1DRD4
SCHEMBL9000174 0.74 RHEB (0.73) MAPTKMT2AMEN1ESR1SMN1; SMN2
SCHEMBL30615082 0.74 RHEB (0.73) MAPTKMT2AMEN1ESR1SMN1; SMN2
SCHEMBL13033438 0.72 DRD4 (0.55) DRD2HTR1AHTR2ADRD4MAPT
SCHEMBL13033451 0.72 DRD4 (0.55) DRD2HTR1AHTR2ADRD4DRD3

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-4559908-A1 HETEROARYL DERIVATIVE COMPOUND AND USE THEREOF S2CBio Inc. (KR) 2025-05-28 — — EP claimed
EP-4559908-A1 HETEROARYL DERIVATIVE COMPOUND AND USE THEREOF S2CBio Inc. (KR) 2025-05-28 — — EP disclosed
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