SCHEMBL7331670

SCHEMBL7331670

O=C(O)C1(C(=O)O)NCCC1O

nearest known ligand 0.32

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GABRP O00591 1/20 0.31
GABRD O14764 1/20 0.31
GABRA1 P14867 1/20 0.31
TSHR P16473 1/20 0.31
GABRB1 P18505 1/20 0.31
GABRG2 P18507 1/20 0.31
GABRB3 P28472 1/20 0.31
GABRA5 P31644 1/20 0.31
GABRA3 P34903 1/20 0.31
GABRA2 P47869 1/20 0.31
GABRB2 P47870 1/20 0.31
GABRA4 P48169 1/20 0.31
GABRE P78334 1/20 0.31
PMP22 Q01453 1/20 0.31
GABRA6 Q16445 1/20 0.31
GABRG1 Q8N1C3 1/20 0.31
GABRG3 Q99928 1/20 0.31
GABRQ Q9UN88 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
SCHEMBL18689833 0.73 MAPK1 (0.34) PMP22
SCHEMBL2183129 0.73 MAPK1 (0.34) PMP22
SCHEMBL7972172 0.71
SCHEMBL7278062 0.69
SCHEMBL9675102 0.67 CYP1A2 (0.34) TSHR
SCHEMBL5961850 0.65
SCHEMBL3578698 0.62 SLC6A1 (0.32) TSHR
SCHEMBL24069841 0.62
SCHEMBL18048096 0.60 ARG1 (0.32) GABRPGABRDGABRA1TSHRGABRB1
SCHEMBL10424405 0.60 MAPK1 (0.31) GABRPGABRDGABRA1TSHRGABRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0413277-B1 Peptide antagonists of bradykinin HOECHST AG (DE) 1994-11-23 EP claimed
US-5712417-A Inhibitors of retroviral proteases ABBOTT LABORATORIES (US) 1998-01-27 US disclosed
US-5686421-A INHIBITING PLATELET AGGREGATION HOECHST AKTIENGESELLSCHAFT (DE) 1997-11-11 US disclosed
US-5681838-A ALSO FOR SUPPRESSING CANCER CELL METASTASES AND BINDING OF OSTEOCLASTS TO BONE SURFACES HOECHST AKTIENGESELLSCHAFT (DE) 1997-10-28 US disclosed
US-5663139-A VIRICIDE OLIGOPEPTIDES HOECHST AKTIENGESELLSCHAFT (DE) 1997-09-02 US disclosed
US-5648333-A POLYPEPTIDES FOR ANTIINFLAMMATORY AGENTS, WOUND HEALING AGENTS, ANTIALLERGENS OR CARDIOVASCULAR DISORDERS HOECHST AKTIENGESELLSCHAFT (DE) 1997-07-15 US disclosed
US-5629431-A Inhibitors of retroviral proteases HOECHST AKTIENGESELLSCHAFT (DE) 1997-05-13 US disclosed
US-5554594-A ANTICOAGULANTS, ANTIMETASTASIS AGENTS CASSELLA AKTIENGESSELLSCHAFT (DE) 1996-09-10 US disclosed
US-5519113-A Process for the diastereoselective reductive pinacol coupling of homochiral α-aminoaldehydes HOECHST AKTIENGESELLSCHAFT (DE) 1996-05-21 US disclosed
US-5463124-A Treating with niobium trichloride-dimethoxyethane complex and simultaneously controlling all four corners of chirality HOECHST AKTIENGESELLSCHAFT (DE) 1995-10-31 US disclosed
US-5424293-A Anticoagulants of platelet aggregation; osteoclast antagonist for treating osteoporosis CASSELLA AG (DE) 1995-06-13 US disclosed
US-5397796-A Inhibitors of platelet aggregation, metastasis of carcinoma cells and osteoclast binding to the bone surfaces CASSELLA AG (DE) 1995-03-14 US disclosed
US-5389614-A Anticoagulants CASSELLA AG (DE) 1995-02-14 US disclosed
US-5326875-A Alkylation of azaglycine derivatives HOECHST AKTIENGESELLSCHAFT (DE) 1994-07-05 US disclosed