SCHEMBL23536252

SCHEMBL23536252

CC(C)(C)OC(=O)N1CCC(c2cc([Si](C)(C)C)on2)CC1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.51
THRB P10828 2/20 0.51
MAPT P10636 1/20 0.51
HTT P42858 2/20 0.49
GPR119 Q8TDV5 6/20 0.48
USP30 Q70CQ3 1/20 0.46
ALDH1A1 P00352 2/20 0.45
HPGD P15428 2/20 0.45
NPSR1 Q6W5P4 1/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
TSHR P16473 1/20 0.43
CRHBP P24387 1/20 0.43
CRHR2 Q13324 1/20 0.43
HSD17B10 Q99714 1/20 0.43
RECQL P46063 1/20 0.43
GAA P10253 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL26128075 0.87 USP30 (0.43) KDM4ETHRBMAPTHTTGPR119
SCHEMBL21245644 0.85 KDM4E (0.54) KDM4ETHRBMAPTHTTGPR119
SCHEMBL30182200 0.83 MAPT (0.49) KDM4ETHRBMAPTHTTGPR119
SCHEMBL25057572 0.82 THRB (0.48) KDM4ETHRBMAPTHTTGPR119
SCHEMBL23536110 0.81 SCD5 (0.38) KDM4ETHRBHTTALDH1A1HPGD
SCHEMBL30182216 0.80 KDM4E (0.46) KDM4ETHRBMAPTHTTGPR119
SCHEMBL24461435 0.79 KDM4E (0.46) KDM4ETHRBMAPTHTTGPR119
SCHEMBL31704973 0.79 ALDH1A1 (0.49) KDM4ETHRBMAPTHTTGPR119
SCHEMBL26683483 0.79 HTT (0.47) KDM4ETHRBMAPTHTTGPR119
SCHEMBL7503348 0.78 SMN1; SMN2 (0.53) KDM4ETHRBGPR119GAASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4076423-A1 TRPML MODULATORS Casma Therapeutics, Inc. (US) 2022-10-26 EP disclosed
CN-115087440-A TRPML modulators 卡斯玛治疗公司 2022-09-20 CN disclosed
WO-2021127333-A1 TRPML MODULATORS CASMA THERAPEUTICS, INC. (US) 2021-06-24 WO disclosed
WO-2021127328-A1 TRPML MODULATORS CASMA THERAPEUTICS, INC. (US) 2021-06-24 WO disclosed
WO-2021127337-A1 TRPML MODULATORS CASMA THERAPEUTICS, INC. (US) 2021-06-24 WO disclosed