SCHEMBL29991650

SCHEMBL29991650

CCN(COC1CCCCC1)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ EPHX1 P07099 1/20 0.41
▸ NAAA Q02083 2/20 0.38
▸ HTT P42858 2/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ NPC1 O15118 2/20 0.32
▸ ADH1C P00326 1/20 0.32
▸ ADH1A P07327 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ RAB9A P51151 1/20 0.32

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
SCHEMBL234362 0.79 ALOX5 (0.42) EPHX1NAAAHTTNPC1CYP2C19
SCHEMBL14759074 0.78 EPHX1 (0.41) EPHX1NAAAHTTALDH1A1NPC1
SCHEMBL11301887 0.77 EPHX1 (0.52) EPHX1NAAAHTTMEN1KMT2A
SCHEMBL237302 0.76 ALOX5 (0.41) EPHX1NAAAHTTNPC1CYP2C19
SCHEMBL14759108 0.76 LMNA (0.39) EPHX1NAAAALDH1A1KMT2ANPC1
SCHEMBL1376315 0.75 LMNA (0.44) EPHX1NAAAALDH1A1MEN1KMT2A
SCHEMBL14759197 0.75 EPHX1 (0.48) EPHX1NAAAHTTALDH1A1MEN1
Bicarbonate SCHEMBL19329248 0.74 EPHX1 (0.47) EPHX1NAAAHTTALDH1A1L3MBTL1
Bicarbonate SCHEMBL7189359 0.74 EPHX1 (0.47) EPHX1NAAAHTTALDH1A1L3MBTL1
SCHEMBL1374286 0.73 LMNA (0.45) EPHX1NAAAALDH1A1SMN1; SMN2L3MBTL1

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-4334307-A1 CDK2 DEGRADERS AND USES THEREOF Kymera Therapeutics, Inc. (US) 2024-03-13 — — EP disclosed
WO-2022236058-A1 CDK2 DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2022-11-10 — — WO disclosed
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