SCHEMBL20731234

SCHEMBL20731234

C[C@H]1CN(Cc2ccccc2)C(=O)[C@@H]1OS(C)(=O)=O

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ GRM2 Q14416 2/20 0.40
▸ HPGD P15428 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ BRD4 O60885 1/20 0.39
▸ PREP P48147 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ CACNA1G O43497 1/20 0.38
▸ CACNA1H O95180 1/20 0.38
▸ CACNA1I Q9P0X4 1/20 0.38
▸ PDE4A P27815 1/20 0.37
▸ PDE4B Q07343 1/20 0.37
▸ PDE4C Q08493 1/20 0.37
▸ PDE4D Q08499 1/20 0.37
▸ MAPT P10636 1/20 0.37

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
SCHEMBL21685864 0.83 SIRT5 (0.38) KMT2AMEN1GRM2HPGDTSHR
SCHEMBL21685866 0.83 SIRT5 (0.38) KMT2AMEN1GRM2HPGDTSHR
SCHEMBL20722557 0.83 SIRT5 (0.38) KMT2AMEN1GRM2HPGDTSHR
SCHEMBL13484174 0.76 HPGD (0.47) KMT2AMEN1GRM2HPGDTSHR
SCHEMBL28657596 0.74 HDAC1 (0.44) KMT2A
SCHEMBL18740361 0.74 HDAC1 (0.44) KMT2A
SCHEMBL21704252 0.74 HDAC1 (0.44) KMT2A
SCHEMBL26119781 0.73 FAAH (0.44) HPGDTSHR
SCHEMBL5745374 0.72 PTPN1 (0.45) KMT2AMEN1
SCHEMBL9846453 0.72 PTPN1 (0.45) KMT2AMEN1

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
WO-2019032863-A1 CARBOXAMIDES AS UBIQUITIN-SPECIFIC PROTEASE INHIBITORS FORMA THERAPEUTICS, INC. (US) 2019-02-14 — — WO disclosed
Send feedback