SCHEMBL9777316

SCHEMBL9777316

CCOC(=O)[C@H](Cc1ccc(OP(=O)(O)O)c(O)c1)NC(=O)[C@H](CCSC)NC(C)=O

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ DRD1 P21728 1/20 0.51
▸ PPID Q08752 1/20 0.41
▸ PTPN1 P18031 1/20 0.41
▸ MME P08473 1/20 0.39
▸ ANPEP P15144 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ TACR1 P25103 3/20 0.38
▸ TAS1R3 Q7RTX0 1/20 0.38
▸ TAS1R1 Q7RTX1 1/20 0.38
▸ FNTA P49354 1/20 0.38
▸ FNTB P49356 1/20 0.38
▸ GRB2 P62993 4/20 0.37
▸ ZAP70 P43403 3/20 0.37
▸ SRC P12931 2/20 0.37
▸ HPGD P15428 1/20 0.36

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
SCHEMBL7303478 0.88 DRD1 (0.53) DRD1PPIDPTPN1MMEANPEP
SCHEMBL7294519 0.82 GRB2 (0.46) PPIDGRB2
SCHEMBL7302573 0.79 MAPT (0.42) TACR1GRB2
SCHEMBL7296829 0.78 GRB2 (0.47) PPIDGRB2
SCHEMBL25471815 0.77 MME (0.45) PTPN1MMEGRB2SRC
SCHEMBL9816930 0.74 DRD1 (0.54) DRD1PTPN1
SCHEMBL9816924 0.74 DRD1 (0.54) DRD1PTPN1
SCHEMBL752327 0.74 DRD1 (0.50) DRD1PPIDL3MBTL1FNTAFNTB
SCHEMBL28016251 0.74 DRD1 (0.50) DRD1PPIDL3MBTL1FNTAFNTB
SCHEMBL9777172 0.74 CAPN1 (0.52) MME

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
US-5073547-A DOPAMINE PRO-DRUG SIMES SOCIETA ITALIANA MEDICINALI E SINTETICI S.P.A. (IT) 1991-12-17 — — US disclosed
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