SCHEMBL4026847

SCHEMBL4026847

CCOC(=O)C1CCN(C(=O)c2ccc(Br)s2)CC1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 2/20 0.61
▸ MAPT P10636 2/20 0.61
▸ MEN1 O00255 3/20 0.60
▸ KMT2A Q03164 3/20 0.60
▸ ALDH1A1 P00352 3/20 0.60
▸ POLB P06746 2/20 0.60
▸ KDM4E B2RXH2 1/20 0.57
▸ HPGD P15428 1/20 0.56
▸ NPC1 O15118 1/20 0.55
▸ TSHR P16473 1/20 0.54
▸ GAA P10253 2/20 0.53
▸ GLA P06280 1/20 0.53
▸ HSD17B10 Q99714 1/20 0.53
▸ RAB9A P51151 1/20 0.53
▸ CYP2C19 P33261 1/20 0.51

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
SCHEMBL4021435 0.80 HPGD (0.67) MAPTKMT2AALDH1A1POLBHPGD
SCHEMBL4925746 0.79 GAA (0.55) RXFP1MAPTMEN1KMT2AALDH1A1
SCHEMBL4029707 0.76 POLB (0.51) RXFP1ALDH1A1POLBKDM4EHPGD
SCHEMBL14409571 0.75 TSHR (0.70) MEN1KMT2AALDH1A1POLBKDM4E
SCHEMBL6973124 0.75 GAA (0.73) MEN1KMT2AALDH1A1POLBKDM4E
SCHEMBL4031125 0.74 SMN1; SMN2 (0.55) RXFP1MAPTKMT2AALDH1A1POLB
SCHEMBL3184163 0.73 HPGD (1.00) KMT2AALDH1A1POLBHPGDNPC1
SCHEMBL3204586 0.73 HPGD (0.93) KMT2AALDH1A1POLBHPGDNPC1
SCHEMBL314589 0.73 TSHR (0.75) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL5721942 0.73 TSHR (0.51) RXFP1MAPTALDH1A1KDM4EHPGD

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
WO-2009098282-A1 LOW MOLECULAR WEIGHT 2,5-DISUBSTITUTED THIOPHENE DERIVATIVES AND USE THEREOF IN THERAPY NOVASAID AB (SE) 2009-08-13 — — WO disclosed
WO-2009098282-A1 LOW MOLECULAR WEIGHT 2,5-DISUBSTITUTED THIOPHENE DERIVATIVES AND USE THEREOF IN THERAPY NOVASAID AB (SE) 2009-08-13 — — WO disclosed
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