SCHEMBL27119016

SCHEMBL27119016

C=CCCC(C(=O)NC)N1Cc2cc(CCCCCCCNC)ccc2C1C

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ S1PR1 P21453 3/20 0.31
▸ S1PR4 O95977 1/20 0.31
▸ S1PR3 Q99500 1/20 0.31
▸ S1PR5 Q9H228 1/20 0.31
▸ FAAH O00519 1/20 0.30
▸ SIGMAR1 Q99720 1/20 0.30

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
SCHEMBL27117690 0.92 S1PR1 (0.32) S1PR1S1PR4S1PR3S1PR5SIGMAR1
SCHEMBL27119910 0.79 DRD1 (0.33) SIGMAR1
SCHEMBL27120160 0.76 SIGMAR1 (0.32) SIGMAR1
SCHEMBL25993969 0.75 SLC6A2 (0.36) —
SCHEMBL27120066 0.73 SIGMAR1 (0.30) SIGMAR1
SCHEMBL25999425 0.72 OPRK1 (0.30) —
SCHEMBL27120419 0.72 S1PR1 (0.31) S1PR1SIGMAR1
SCHEMBL27113705 0.71 MMP1 (0.33) S1PR1FAAH
SCHEMBL25993020 0.70 SLC6A2 (0.33) —
SCHEMBL26021674 0.69 PDK2 (0.33) —

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-4076650-B1 3-(5-METHOXY-1-OXOISOINDOLIN-2-YL)PIPERIDINE-2,6-DIONE DERIVATIVES AND USES THEREOF NOVARTIS AG (CH) 2024-02-28 — — EP disclosed
Send feedback