SCHEMBL16826429

SCHEMBL16826429

CC(Oc1ccc(Cl)cc1)C(=O)N1CCN(C(=O)O)CC1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 2/20 0.54
▸ HSD17B10 Q99714 2/20 0.54
▸ HPGD P15428 3/20 0.53
▸ SMN1; SMN2 Q16637 2/20 0.53
▸ LMNA P02545 1/20 0.53
▸ MAPT P10636 1/20 0.53
▸ ALOX12 P18054 1/20 0.53
▸ HTT P42858 1/20 0.53
▸ NPSR1 Q6W5P4 1/20 0.53
▸ KMT2A Q03164 3/20 0.52
▸ ALDH1A1 P00352 3/20 0.49
▸ KDM4E B2RXH2 1/20 0.48
▸ CYP1A2 P05177 1/20 0.46
▸ CYP2C9 P11712 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ MEN1 O00255 1/20 0.45
▸ GAA P10253 1/20 0.45

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
SCHEMBL16826397 0.85 ALDH1A1 (0.66) ALOX15HSD17B10HPGDSMN1; SMN2LMNA
SCHEMBL16825685 0.84 HPGD (0.52) ALOX15HSD17B10HPGDSMN1; SMN2LMNA
SCHEMBL16825683 0.84 HPGD (0.52) ALOX15HSD17B10HPGDSMN1; SMN2LMNA
SCHEMBL16826292 0.84 HPGD (0.52) ALOX15HSD17B10HPGDSMN1; SMN2LMNA
SCHEMBL8020109 0.83 SMN1; SMN2 (0.58) ALOX15HSD17B10SMN1; SMN2LMNAHTT
SCHEMBL18129134 0.83 KMT2A (0.43) ALOX15HSD17B10HPGDSMN1; SMN2LMNA
SCHEMBL16846200 0.82 KMT2A (0.56) ALOX15HSD17B10HPGDSMN1; SMN2LMNA
SCHEMBL16825671 0.82 KMT2A (0.56) ALOX15HSD17B10HPGDSMN1; SMN2LMNA
SCHEMBL16846161 0.82 KMT2A (0.56) ALOX15HSD17B10HPGDSMN1; SMN2LMNA
SCHEMBL22221483 0.81 MAPT (0.52) ALOX15HSD17B10HPGDSMN1; SMN2LMNA

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
EP-3082805-A1 SUBSTITUTED AMINO TRIAZOLES, AND METHODS USING SAME The Institute For Drug Delivery (US) 2016-10-26 — — EP disclosed
WO-2015095701-A1 SUBSTITUTED AMINO TRIAZOLES, AND METHODS USING SAME THE INSTITUTE FOR DRUG DELIVERY (US) 2015-06-25 — — WO disclosed
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