SCHEMBL11504081

SCHEMBL11504081

Cc1ccc(CN(C(=O)OC(C)(C)C)[C@@H](CS)C(=O)O)cc1C

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 1/20 0.37
▸ LMNA P02545 2/20 0.36
▸ ALDH1A1 P00352 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ HDAC3 O15379 1/20 0.35
▸ HDAC1 Q13547 1/20 0.35
▸ HDAC2 Q92769 1/20 0.35
▸ NCOR2 Q9Y618 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.34
▸ PPARG P37231 1/20 0.32
▸ SLC7A5 Q01650 1/20 0.32
▸ CD274 Q9NZQ7 1/20 0.32
▸ PSMB8 P28062 1/20 0.31
▸ PSMB5 P28074 1/20 0.31

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
SCHEMBL9728397 0.88 ALDH1A1 (0.39) ACELMNAALDH1A1POLBHSD17B10
SCHEMBL9331526 0.86 ALDH1A1 (0.39) LMNAALDH1A1POLBHSD17B10L3MBTL1
SCHEMBL2580570 0.85 L3MBTL1 (0.47) LMNAALDH1A1POLBHSD17B10L3MBTL1
SCHEMBL7276228 0.85 L3MBTL1 (0.47) LMNAALDH1A1POLBHSD17B10L3MBTL1
SCHEMBL10519344 0.83 LDHA (0.43) ACEALDH1A1L3MBTL1SMN1; SMN2TDP1
SCHEMBL11400130 0.83 LDHA (0.43) ACEALDH1A1L3MBTL1SMN1; SMN2TDP1
SCHEMBL11579749 0.83 LDHA (0.43) ACEALDH1A1L3MBTL1SMN1; SMN2TDP1
SCHEMBL2544891 0.75 ALDH1A1 (0.39) LMNAALDH1A1POLBHSD17B10L3MBTL1
SCHEMBL1928929 0.75 L3MBTL1 (0.40) LMNAALDH1A1POLBHSD17B10L3MBTL1
SCHEMBL1928928 0.75 L3MBTL1 (0.40) LMNAALDH1A1POLBHSD17B10L3MBTL1

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-4159263-A INHIBIT RELEASE OF GROWTH HORMONE AND INSULIN AMERICAN HOME PRODUCTS CORPORATION (US) 1979-06-26 — — US disclosed
US-4123425-A POLYPEPTIDES, HORMONE RELEASE INHIBITORS AMERICAN HOME PRODUCTS CORPORATION (US) 1978-10-31 — — US disclosed
US-4100153-A TREATMENT OF HYPERINSULINEMIA AND ACROMEGALY AMERICAN HOME PRODUCTS CORPORATION (US) 1978-07-11 — — US disclosed
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