SCHEMBL10779408

SCHEMBL10779408

C[C@H](N=C1CCOc2ccc(Cl)cc21)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
CYP19A1 P11511 1/20 0.38
MAOB P27338 1/20 0.36
MAPT P10636 5/20 0.36
TP53 P04637 3/20 0.36
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.36
ALDH1A1 P00352 2/20 0.36
PIK3CA P42336 2/20 0.36
PIK3CB P42338 2/20 0.36
PIK3CG P48736 2/20 0.36
THRB P10828 1/20 0.35
FABP4 P15090 1/20 0.35
MAP3K14 Q99558 1/20 0.35
KDM4E B2RXH2 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
NPC1 O15118 1/20 0.34
POLB P06746 1/20 0.34
RAB9A P51151 1/20 0.34

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
SCHEMBL10779405 1.00 CTSL (0.51) CTSLNPSR1CYP19A1MAOBMAPT
SCHEMBL10916746 0.85 ALDH1A1 (0.51) CTSLNPSR1CYP19A1MAPTALDH1A1
SCHEMBL10780584 0.85 ALDH1A1 (0.51) CTSLNPSR1CYP19A1MAPTALDH1A1
SCHEMBL13114090 0.76 NPSR1 (0.58) CTSLNPSR1CYP19A1MAOBMAPT
SCHEMBL20205932 0.76 NPSR1 (0.62) CTSLNPSR1CYP19A1MAOBMAPT
SCHEMBL7878503 0.73 CTSL (0.62) CTSLNPSR1CYP19A1MAOBMAPT
SCHEMBL29991312 0.73 CTSL (0.62) CTSLNPSR1CYP19A1MAOBMAPT
SCHEMBL7878501 0.73 CTSL (0.62) CTSLNPSR1CYP19A1MAOBMAPT
SCHEMBL21836221 0.69 MEN1 (0.38) CTSLNPSR1CYP19A1LMNAALDH1A1
SCHEMBL21836220 0.69 MEN1 (0.38) CTSLNPSR1CYP19A1LMNAALDH1A1

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-0145895-B1 INTERMEDIATES USEFUL IN THE PREPARATION OF CERTAIN CHIRAL HYDANTOINS, INCLUDING SORBINIL PFIZER INC. (US) 1987-03-04 EP disclosed
EP-0037672-B1 PROCESS FOR THE PREPARATION OF CHIRAL HYDANTOINS, AND A NOVEL HYDANTOIN PRODUCED BY SAID PROCESS AND A PHARMACEUTICAL COMPOSITION CONTAINING IT PFIZER INC. (US) 1986-05-14 EP disclosed
EP-0145895-A1 Intermediates useful in the preparation of certain chiral hydantoins, including sorbinil PFIZER INC. (US) 1985-06-26 EP disclosed
US-4419521-A ANTIDIABETIC AGENTS PFIZER INC. (US) 1983-12-06 US disclosed
US-4348526-A COMPLICATIONS OF DIABETES PFIZER INC. (US) 1982-09-07 US disclosed
EP-0037672-A2 Process for the preparation of chiral hydantoins, and a novel hydantoin produced by said process and a pharmaceutical composition containing it PFIZER INC. (US) 1981-10-14 EP disclosed
US-4286098-A HYPOGLYCEMIC AGENTS, TREATMENT OF DIABETES COMPLICATIONS PFIZER INC. (US) 1981-08-25 US disclosed