SCHEMBL7745574

SCHEMBL7745574

CC(C)(C)OC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)NCc1ccccc1Cl

nearest known ligand 0.72

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CTSL P07711 4/20 0.72
CTSS P25774 1/20 0.72
CTSK P43235 1/20 0.72
MAPT P10636 4/20 0.63
TP53 P04637 1/20 0.63
TACR1 P25103 2/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
LMNA P02545 1/20 0.59
TERT O14746 2/20 0.59
BCHE P06276 1/20 0.57
ACHE P22303 1/20 0.57
CCKBR P32239 2/20 0.57
GAA P10253 1/20 0.56
HTT P42858 1/20 0.56
ACE P12821 1/20 0.56

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
SCHEMBL8482130 0.90 CTSL (0.73) CTSLCTSSCTSKMAPTTP53
SCHEMBL6299745 0.89 TACR1 (0.75) CTSLCTSSCTSKMAPTTP53
SCHEMBL9834534 0.88 CTSL (0.80) CTSLCTSSCTSKMAPTTP53
SCHEMBL17807348 0.86 CTSL (0.80) CTSLCTSSCTSKMAPTTP53
SCHEMBL8815278 0.85 TACR3 (0.61) CTSLCTSSCTSKMAPTTACR1
SCHEMBL8271104 0.85 CTSL (0.72) CTSLCTSSCTSKMAPTTP53
SCHEMBL8395025 0.85 CTSL (0.72) CTSLCTSSCTSKMAPTTP53
SCHEMBL7743161 0.84 NMBR (0.61) CTSLCTSSCTSKMAPTTACR1
SCHEMBL21269082 0.84 CTSL (0.77) CTSLCTSSCTSKMAPTTP53
SCHEMBL21286953 0.84 CTSL (0.77) CTSLCTSSCTSKMAPTTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0819005-A4 2-ACYLAMINOPROPANAMIDES AS TACHYKININ RECEPTOR ANTAGONISTS LILLY CO ELI (US) 2001-03-21 EP disclosed
US-5792760-A USEFUL IN TREATMENT OF PSYCHOLOGICAL AND CENTRAL NERVOUS SYSTEM DISORDERS ELI LILLY AND COMPANY (US) 1998-08-11 US disclosed
US-5773441-A PRODRUGS; ANIMAL HUSBANDRY ELI LILLY AND COMPANY (US) 1998-06-30 US disclosed
EP-0819005-A1 2-ACYLAMINOPROPANAMIDES AS TACHYKININ RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 1998-01-21 EP disclosed
EP-0761220-A1 2-Acylaminopropanamides as growth hormone secretagogues ELI LILLY AND COMPANY (US) 1997-03-12 EP disclosed
US-5565568-A USEFUL IN TREATMENT OR PREVENTION OF A PHYSIOLOGICAL DISORDER ASSOCIATED WITH AN EXCESS OF TACHYKININS ELI LILLY AND COMPANY (US) 1996-10-15 US disclosed
WO-1996031214-A1 2-ACYLAMINOPROPANAMIDES AS TACHYKININ RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 1996-10-10 WO disclosed