SCHEMBL11288558

SCHEMBL11288558

O=C1COC2(CCN(CC(=O)c3ccc(F)cc3)CC2)CN1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.46
▸ KDM4E B2RXH2 3/20 0.46
▸ TSHR P16473 2/20 0.46
▸ HTT P42858 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ HTR2A P28223 6/20 0.43
▸ HTR2C P28335 4/20 0.43
▸ KCNH2 Q12809 1/20 0.41
▸ HPGD P15428 2/20 0.40
▸ MAPT P10636 2/20 0.40
▸ LMNA P02545 1/20 0.40
▸ HSD17B10 Q99714 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ USP2 O75604 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ DRD2 P14416 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
SCHEMBL11292863 0.89 DRD2 (0.51) TSHRHTR2AHTR2CKCNH2LMNA
SCHEMBL11280131 0.87 DRD2 (0.57) TSHRHTR2AHTR2CKCNH2LMNA
SCHEMBL11282395 0.79 LMNA (0.54) ALDH1A1TSHRHTR2AHTR2CKCNH2
SCHEMBL11285348 0.76 DRD2 (0.45) TSHRHTR2AHTR2CKCNH2LMNA
SCHEMBL11288334 0.76 DRD2 (0.53) TSHRHTR2AHTR2CKCNH2LMNA
SCHEMBL11287182 0.76 DRD2 (0.57) TSHRHTR2AHTR2CKCNH2MEN1
SCHEMBL11277513 0.75 DRD2 (0.56) ALDH1A1TSHRHTR2AHTR2CKCNH2
SCHEMBL11285556 0.73 DRD2 (0.44) LMNADRD2
SCHEMBL11283016 0.73 DRD2 (0.53) ALDH1A1HTTHTR2AHTR2CMAPT
SCHEMBL11282980 0.72 DRD2 (0.41) TSHRHTR2AHTR2CKCNH2LMNA

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
US-4353900-A HYPOTENSIVE, ANTIARRHYTHMIA, CARDIOTONIC, VASODILATORS SYNTEX (U.S.A.) INC. (US) 1982-10-12 — — US disclosed
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