SCHEMBL11194045

SCHEMBL11194045

C[C@@H](CN1C(C(=O)O)CSC1c1ccccc1O)C(=O)SSC(=O)[C@@H](C)CN1C(C(=O)O)CSC1c1ccccc1O

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 3/20 0.51
▸ ALDH1A1 P00352 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ LMNA P02545 1/20 0.36
▸ FFAR2 O15552 7/20 0.36
▸ HTT P42858 1/20 0.34
▸ KMT2A Q03164 1/20 0.33

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
SCHEMBL11219804 0.85 ACE (0.36) ACEALDH1A1POLBHPGDLMNA
SCHEMBL11194340 0.80 TERT (0.38) ACEFFAR2
SCHEMBL11263001 0.80 POLB (0.40) ACEALDH1A1POLBHPGDFFAR2
SCHEMBL11190617 0.79 FFAR2 (0.44) ACEALDH1A1POLBHPGDLMNA
SCHEMBL11184581 0.79 POLB (0.40) ALDH1A1POLBHPGDFFAR2KMT2A
SCHEMBL10969787 0.78 ACE (0.57) ACEALDH1A1POLBHPGDLMNA
SCHEMBL11189268 0.78 ALDH1A1 (0.44) ALDH1A1POLB
SCHEMBL11192054 0.77 ACE (0.36) ACEALDH1A1
SCHEMBL11201178 0.77 GAA (0.42) POLBFFAR2
SCHEMBL11202283 0.77 POLB (0.38) ALDH1A1POLBHPGDFFAR2KMT2A

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-4347371-A HYPERTENSIVE AGENTS; ANTIDIABETIC AGENTS; VISION DEFECTS SANTEN PHARMACEUTICAL CO., LTD. (JP) 1982-08-31 — — US claimed
US-4410542-A HYPOTENSIVE AGENTS, PYRROLINE-1,2-DICARBOXYLIC ACID DERIVATIVES SANTEN PHARMACEUTICAL CO., LTD. (JP) 1983-10-18 — — US disclosed
US-4347371-A HYPERTENSIVE AGENTS; ANTIDIABETIC AGENTS; VISION DEFECTS SANTEN PHARMACEUTICAL CO., LTD. (JP) 1982-08-31 — — US disclosed
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