SCHEMBL26004274

SCHEMBL26004274

CCc1ccc2c(c1)C1(CCN(Cc3cnn(-c4ccccc4)c3)CC1)OC2C(N)=O

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 3/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ DRD4 P21917 6/20 0.45
▸ DRD2 P14416 5/20 0.45
▸ DRD3 P35462 4/20 0.45
▸ HTR2C P28335 1/20 0.41
▸ MAPK1 P28482 2/20 0.41
▸ RECQL P46063 1/20 0.41
▸ KCNH2 Q12809 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ LMNA P02545 1/20 0.40

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
SCHEMBL25357836 1.00 SIGMAR1 (0.49) SIGMAR1MEN1KMT2ADRD4DRD2
SCHEMBL26004214 0.91 SIGMAR1 (0.49) SIGMAR1MEN1KMT2ADRD4DRD2
SCHEMBL26004276 0.90 MEN1 (0.47) SIGMAR1MEN1KMT2ADRD4DRD2
SCHEMBL25362300 0.90 MEN1 (0.47) SIGMAR1MEN1KMT2ADRD4DRD2
SCHEMBL25359488 0.89 DRD4 (0.51) SIGMAR1MEN1KMT2ADRD4DRD2
SCHEMBL26012439 0.89 DRD4 (0.51) SIGMAR1MEN1KMT2ADRD4DRD2
SCHEMBL25361546 0.89 MEN1 (0.47) SIGMAR1MEN1KMT2ADRD4DRD2
SCHEMBL26005046 0.89 MEN1 (0.47) SIGMAR1MEN1KMT2ADRD4DRD2
SCHEMBL30623427 0.88 MEN1 (0.44) SIGMAR1MEN1KMT2ADRD4DRD2
SCHEMBL25361339 0.88 MEN1 (0.44) SIGMAR1MEN1KMT2ADRD4DRD2

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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