SCHEMBL7340659

SCHEMBL7340659

CCOC(=O)[C@H]1CC(C)=CCN1Cc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ POLB P06746 1/20 0.45
▸ ALDH1A1 P00352 4/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ SIGMAR1 Q99720 2/20 0.42
▸ PKM P14618 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ ATM Q13315 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ NR1D1 P20393 1/20 0.41
▸ CCR8 P51685 1/20 0.41

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
Hydrochloric Acid SCHEMBL7437948 0.99 MEN1 (0.47) MEN1KMT2APOLBALDH1A1KDM4E
SCHEMBL8126352 0.85 GRM6 (0.47) ALDH1A1SMN1; SMN2
SCHEMBL8126349 0.85 GRM6 (0.47) ALDH1A1SMN1; SMN2
Hydrochloric Acid SCHEMBL7450701 0.84 GRM6 (0.46) ALDH1A1SMN1; SMN2
Hydrochloric Acid SCHEMBL7450698 0.84 GRM6 (0.46) ALDH1A1SMN1; SMN2
SCHEMBL4663816 0.83 MEN1 (0.49) MEN1KMT2APOLBALDH1A1KDM4E
SCHEMBL8275351 0.83 MEN1 (0.49) MEN1KMT2APOLBALDH1A1KDM4E
SCHEMBL4663812 0.83 MEN1 (0.49) MEN1KMT2APOLBALDH1A1KDM4E
SCHEMBL11147455 0.82 MEN1 (0.55) MEN1KMT2APOLBALDH1A1KDM4E
SCHEMBL2769755 0.79 MEN1 (0.64) MEN1KMT2APOLBALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0822934-B1 ANTITHROMBOTIC AMIDINOTETRAHYDROPYRIDYLALANINE DERIVATIVES PFIZER RES & DEV (IE) 2000-02-09 — — EP disclosed
US-5861393-A THROMBIN INHIBITORS; VASCULAR, CARDIOVASCULAR, NERVOUS SYSTEM AND BRAIN DISORDERS; ANTIISCHEMIC AND ANTIINFLAMMATORY AGENTS; RESTENOSIS PFIZER INC. (US) 1999-01-19 — — US disclosed
US-5798352-A Antithrombotic amidinotetrahydropyridylalanine derivatives PFIZER INC. (US) 1998-08-25 — — US disclosed
US-5750520-A SELECTIVE THROMBIN INHIBITORS; WOUND HEALING AGENTS PFIZER INC. (US) 1998-05-12 — — US disclosed
EP-0822934-A1 ANTITHROMBOTIC AMIDINOTETRAHYDROPYRIDYLALANINE DERIVATIVES Pfizer Research and Development Company, N.V./S.A. (IE) 1998-02-11 — — EP disclosed
EP-0728132-B1 ANTITHROMBOTIC AMIDINOPHENYLALANINE AND AMIDINOPYRIDYLALANINE DERIVATIVES PFIZER LTD (GB) 1997-07-16 — — EP disclosed
WO-1996033993-A1 ANTITHROMBOTIC AMIDINOTETRAHYDROPYRIDYLALANINE DERIVATIVES PFIZER RESEARCH AND DEVELOPMENT COMPANY, N.V./S.A. (IE) 1996-10-31 — — WO disclosed
EP-0728132-A1 ANTITHROMBOTIC AMIDINOPHENYLALANINE AND AMIDINOPYRIDYLALANINE DERIVATIVES PFIZER LTD (GB) 1996-08-28 — — EP disclosed
WO-1995013274-A1 ANTITHROMBOTIC AMIDINOPHENYLALANINE AND AMIDINOPYRIDYLALANINE DERIVATIVES PFIZER LIMITED (GB) 1995-05-18 — — WO disclosed
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