SCHEMBL14857329

SCHEMBL14857329

CCCCCCCCCCCCCCOC1=CC(=O)C(C(=O)OCC(=O)N2CCOCC2)O1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 3/20 0.51
▸ SMN1; SMN2 Q16637 3/20 0.43
▸ LMNA P02545 2/20 0.43
▸ NPC1 O15118 2/20 0.42
▸ FKBP1A P62942 4/20 0.42
▸ ALDH1A1 P00352 2/20 0.41
▸ TP53 P04637 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.40
▸ GLA P06280 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ THRB P10828 1/20 0.39

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
SCHEMBL14857328 0.84 KDM4E (0.41) POLBSMN1; SMN2ALDH1A1TP53KDM4E
SCHEMBL14857330 0.84 THRB (0.48) SMN1; SMN2LMNAALDH1A1KDM4EGAA
SCHEMBL14857326 0.84 THRB (0.48) POLBSMN1; SMN2LMNANPC1ALDH1A1
SCHEMBL14857112 0.79 L3MBTL1 (0.45) ALDH1A1
SCHEMBL14857296 0.76 PPARG (0.39) LMNANPC1ALDH1A1TP53RAB9A
SCHEMBL14857331 0.74 TSHR (0.36) LMNAALDH1A1TP53
SCHEMBL14857301 0.74 TSHR (0.36) LMNAALDH1A1
SCHEMBL14857312 0.74 KMT2A (0.40) POLBLMNAALDH1A1GAATHRB
SCHEMBL14857335 0.73 ALDH1A1 (0.36) POLBSMN1; SMN2NPC1ALDH1A1RAB9A
SCHEMBL19818799 0.71 L3MBTL1 (0.64) POLBSMN1; SMN2LMNANPC1FKBP1A

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-2451796-B1 TOFA ANALOGS USEFUL IN TREATING DERMATOLOGICAL DISORDERS OR CONDITIONS DERMIRA CANADA INC (US) 2013-04-17 — — EP claimed
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