SCHEMBL10404382

SCHEMBL10404382

CC(C)[C@H](NS(=O)(=O)c1ccccc1)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.54
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ CMA1 P23946 1/20 0.51
▸ MEN1 O00255 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ ACE P12821 4/20 0.48
▸ TAAR1 Q96RJ0 1/20 0.47
▸ MMP9 P14780 2/20 0.47
▸ MMP2 P08253 2/20 0.47
▸ MMP3 P08254 2/20 0.47
▸ MMP13 P45452 2/20 0.47
▸ ADAMTS4 O75173 1/20 0.47
▸ MMP1 P03956 1/20 0.47
▸ MMP7 P09237 1/20 0.47
▸ LTA4H P09960 2/20 0.46
▸ ELANE P08246 1/20 0.46
▸ ITGB3 P05106 1/20 0.46
▸ ITGB1 P05556 1/20 0.46
▸ ITGAV P06756 1/20 0.46
▸ ITGA5 P08648 1/20 0.46

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
SCHEMBL20484583 0.90 POLB (0.54) POLBSMN1; SMN2CMA1MEN1KMT2A
SCHEMBL18620665 0.90 POLB (0.54) POLBSMN1; SMN2CMA1MEN1KMT2A
SCHEMBL10402600 0.89 KMT2A (0.54) POLBSMN1; SMN2CMA1KMT2AACE
SCHEMBL10402345 0.89 KMT2A (0.54) POLBSMN1; SMN2CMA1KMT2AACE
SCHEMBL10404111 0.88 SMN1; SMN2 (0.64) POLBSMN1; SMN2ACELTA4HITGB3
SCHEMBL10403271 0.85 FKBP1A (0.54) CMA1ACEMMP13ADAMTS4ELANE
SCHEMBL15251747 0.83 MEN1 (0.52) POLBSMN1; SMN2MEN1KMT2AACE
SCHEMBL15251748 0.83 MEN1 (0.52) POLBSMN1; SMN2MEN1KMT2AACE
SCHEMBL15252105 0.83 MEN1 (0.52) POLBSMN1; SMN2MEN1KMT2AACE
SCHEMBL10402436 0.81 POLB (0.49) POLBSMN1; SMN2ACELTA4HLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4971993-A HYPOTENSIVE DIPEPTIDES DERIVATIVES AJINOMOTO CO., INC. (JP) 1990-11-20 — — US claimed
US-4971993-A HYPOTENSIVE DIPEPTIDES DERIVATIVES AJINOMOTO CO., INC. (JP) 1990-11-20 — — US disclosed
EP-0190852-A2 Dipeptide derivatives and antihypertensive drugs containing them AJINOMOTO CO., INC. (JP) 1986-08-13 — — EP disclosed
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