SCHEMBL26012439

SCHEMBL26012439

NC(=O)C1OC2(CCN(Cc3cnn(-c4ccccc4)c3)CC2)c2cc(Cl)ccc21

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ DRD4 P21917 7/20 0.51
▸ DRD2 P14416 5/20 0.51
▸ DRD3 P35462 4/20 0.51
▸ HTR2C P28335 2/20 0.51
▸ MAPK1 P28482 1/20 0.49
▸ RECQL P46063 1/20 0.49
▸ SIGMAR1 Q99720 2/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ KCNH2 Q12809 1/20 0.41

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
SCHEMBL25359488 1.00 DRD4 (0.51) DRD4DRD2DRD3HTR2CMAPK1
SCHEMBL26012504 0.93 DRD4 (0.52) DRD4DRD2DRD3HTR2CMAPK1
SCHEMBL30623379 0.93 DRD4 (0.52) DRD4DRD2DRD3HTR2CMAPK1
SCHEMBL25356801 0.93 DRD4 (0.52) DRD4DRD2DRD3HTR2CMAPK1
SCHEMBL26004506 0.92 DRD4 (0.42) DRD4DRD2DRD3HTR2CMAPK1
SCHEMBL26004214 0.90 SIGMAR1 (0.49) DRD4DRD2DRD3HTR2CMAPK1
SCHEMBL25356312 0.90 MAPK1 (0.45) DRD4DRD2DRD3HTR2CMAPK1
SCHEMBL26013337 0.90 MAPK1 (0.45) DRD4DRD2DRD3HTR2CMAPK1
SCHEMBL25360180 0.89 DRD4 (0.45) DRD4DRD2DRD3HTR2CMAPK1
SCHEMBL25359715 0.89 DRD4 (0.48) DRD4DRD2DRD3HTR2CMAPK1

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-4476207-A1 SPIRO PIPERIDINE DERIVATIVES AS INHIBITORS OF APOL1 AND METHODS OF USING SAME Vertex Pharmaceuticals Incorporated (US) 2024-12-18 — — EP disclosed
WO-2023154314-A1 SPIRO PIPERIDINE DERIVATIVES AS INHIBITORS OF APOL1 AND METHODS OF USING SAME VERTEX PHARMACEUTICALS INCORPORATED (US) 2023-08-17 — — WO disclosed
WO-2023154314-A1 SPIRO PIPERIDINE DERIVATIVES AS INHIBITORS OF APOL1 AND METHODS OF USING SAME VERTEX PHARMACEUTICALS INCORPORATED (US) 2023-08-17 — — WO disclosed
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