SCHEMBL24100386

SCHEMBL24100386

C=C1CCN(C(=O)c2cnc3c(c2)OCCN3c2ccc(C(=O)OC(C)(C)C)cc2)CC1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ USP30 Q70CQ3 1/20 0.38
▸ GRM5 P41594 1/20 0.38
▸ HPGD P15428 4/20 0.34
▸ CRBN Q96SW2 1/20 0.34
▸ TSHR P16473 3/20 0.34
▸ SMN1; SMN2 Q16637 3/20 0.34
▸ RECQL P46063 1/20 0.34
▸ PIK3CA P42336 3/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ KMT2A Q03164 3/20 0.32
▸ VNN1 O95497 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ HSP90AA1 P07900 1/20 0.32
▸ HSP90AB1 P08238 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
SCHEMBL22226579 0.91 HPGD (0.43) USP30GRM5HPGDTSHRSMN1; SMN2
SCHEMBL24099642 0.90 SMN1; SMN2 (0.42) USP30GRM5HPGDSMN1; SMN2PIK3CA
SCHEMBL24100527 0.90 HPGD (0.45) USP30GRM5HPGDTSHRRECQL
SCHEMBL24101118 0.89 HPGD (0.47) USP30GRM5HPGDPIK3CAALDH1A1
SCHEMBL22227266 0.87 HPGD (0.45) USP30GRM5HPGDCRBNTSHR
SCHEMBL24100180 0.86 HPGD (0.39) USP30GRM5HPGDCRBNTSHR
SCHEMBL22226872 0.86 USP30 (0.38) USP30GRM5HPGDCRBNTSHR
SCHEMBL22226783 0.85 GRM5 (0.44) USP30GRM5CRBNPIK3CAKMT2A
SCHEMBL22227202 0.84 USP30 (0.42) USP30GRM5HPGDCRBNPIK3CA
SCHEMBL24100462 0.83 PIK3CA (0.37) GRM5HPGDTSHRSMN1; SMN2RECQL

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-3922247-A1 15-PGDH INHIBITOR Kyorin Pharmaceutical Co., Ltd. (JP) 2021-12-15 — — EP disclosed
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