SCHEMBL8700454

SCHEMBL8700454

CC(CC=O)NC(=O)OCc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 1/20 0.56
▸ CTSK P43235 7/20 0.53
▸ CTRB1 P17538 2/20 0.52
▸ ELANE P08246 2/20 0.52
▸ CTSS P25774 5/20 0.51
▸ CTSL P07711 4/20 0.51
▸ CTSB P07858 3/20 0.50
▸ PRTN3 P24158 1/20 0.49

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
SCHEMBL14174702 1.00 ATM (0.56) ATMCTSKCTRB1ELANECTSS
Isobutane SCHEMBL18261541 0.95 ATM (0.51) ATMCTSKCTRB1ELANECTSS
SCHEMBL14317559 0.87 ATM (0.54) ATMCTSKCTRB1ELANECTSS
SCHEMBL16473698 0.87 ATM (0.54) ATMCTSKCTRB1ELANECTSS
SCHEMBL9970646 0.87 ATM (0.54) ATMCTSKCTRB1ELANECTSS
SCHEMBL14247228 0.87 ATM (0.54) ATMCTSKCTRB1ELANECTSS
SCHEMBL27973260 0.85 ATM (0.52) ATMCTSKCTRB1ELANECTSS
SCHEMBL5482712 0.84 ATM (0.57) ATMCTSKCTRB1ELANECTSS
SCHEMBL18857044 0.84 SMN1; SMN2 (0.62) ATMCTSL
SCHEMBL12283147 0.83 CYP3A4 (0.56) ATMCTSKCTRB1ELANECTSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4863903-A RENIN ENZYME INHIBITORS, HYPOTENSIVE AGENTS CIBA-GEIGY CORPORATION (US) 1989-09-05 — — US claimed
EP-0143746-A2 5-Amino 4-hydroxy-valeryl-substituted derivatives CIBA-GEIGY AG (CH) 1985-06-05 — — EP claimed
US-5834460-A FOR TREATMENT OF BRAIN OR PSYCHOLOGICAL DISORDERS, ALZHEIMER*S DISEASE, MENTAL RETARDATION OR AUTISM YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1998-11-10 — — US disclosed
EP-0696586-A1 SERINE DERIVATIVE YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1996-02-14 — — EP disclosed
US-4863903-A RENIN ENZYME INHIBITORS, HYPOTENSIVE AGENTS CIBA-GEIGY CORPORATION (US) 1989-09-05 — — US disclosed
US-4719288-A HYPOTENSIVE CIBA-GEIGY CORPORATION (US) 1988-01-12 — — US disclosed
US-4613676-A PEPTIDES CIBA-GEIGY CORPORATION (US) 1986-09-23 — — US disclosed
EP-0143746-A2 5-Amino 4-hydroxy-valeryl-substituted derivatives CIBA-GEIGY AG (CH) 1985-06-05 — — EP disclosed
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