SCHEMBL22226705

SCHEMBL22226705

COC(=O)c1ccc2c(c1C1CC1)OCCN2c1ccc(C(=O)OC(C)(C)C)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ USP30 Q70CQ3 1/20 0.38
▸ ALDH1A1 P00352 7/20 0.37
▸ MAPT P10636 4/20 0.37
▸ KDM4E B2RXH2 4/20 0.37
▸ NPC1 O15118 3/20 0.37
▸ RAB9A P51151 3/20 0.37
▸ HPGD P15428 3/20 0.37
▸ TP53 P04637 1/20 0.35
▸ THRB P10828 1/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ ALOX15 P16050 2/20 0.34
▸ HSD17B10 Q99714 2/20 0.34
▸ MGLL Q99685 1/20 0.34
▸ NR1H2 P55055 1/20 0.34
▸ NR1H3 Q13133 1/20 0.34
▸ KDM4D Q6B0I6 1/20 0.34
▸ SRD5A1 P18405 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33

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
SCHEMBL30874438 1.00 USP30 (0.38) USP30ALDH1A1MAPTKDM4ENPC1
SCHEMBL22207532 0.91 USP30 (0.35) USP30MAPTKDM4EHPGDTP53
SCHEMBL28602324 0.87 POLB (0.38) USP30ALDH1A1HPGDTP53MEN1
SCHEMBL22207502 0.87 ABL1 (0.35) USP30ALDH1A1MAPTKDM4ENPC1
SCHEMBL22226828 0.86 SRD5A1 (0.37) USP30ALDH1A1MAPTKDM4ENPC1
SCHEMBL30874416 0.86 SRD5A1 (0.37) USP30ALDH1A1MAPTKDM4ENPC1
SCHEMBL24099732 0.85 HDAC1 (0.36) USP30ALDH1A1MAPTKDM4ENPC1
SCHEMBL22226787 0.79 SRD5A1 (0.38) USP30ALDH1A1SMN1; SMN2SRD5A1CYP1A2
SCHEMBL22207522 0.77 SRD5A1 (0.35) USP30SRD5A1
SCHEMBL22226918 0.77 USP30 (0.48) USP30ALDH1A1MAPTKDM4ENPC1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113226310-B 15-PGDH inhibitors 杏林制药株式会社 2024-03-19 — — CN disclosed
EP-3922247-A1 15-PGDH INHIBITOR Kyorin Pharmaceutical Co., Ltd. (JP) 2021-12-15 — — EP disclosed
CN-113226310-A 15-PGDH inhibitors 杏林制药株式会社 2021-08-06 — — CN disclosed
WO-2020145250-A1 15-PGDH INHIBITOR 杏林製薬株式会社 2020-07-16 — — WO disclosed
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