SCHEMBL205217

SCHEMBL205217

O=C(OCc1ccccc1)C1CCN(C(=O)O)CC1

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.65
NPC1 O15118 4/20 0.65
RAB9A P51151 3/20 0.65
CYP2C19 P33261 1/20 0.62
MAPT P10636 1/20 0.53
HTT P42858 1/20 0.52
MEN1 O00255 1/20 0.51
POLB P06746 1/20 0.51
KMT2A Q03164 1/20 0.51
KDM4E B2RXH2 3/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
PKM P14618 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
ALDH1A1 P00352 1/20 0.49
HSD17B10 Q99714 1/20 0.49
FABP7 O15540 1/20 0.49
FABP5 Q01469 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
SCHEMBL6642777 0.91 SMN1; SMN2 (0.62) SMN1; SMN2NPC1RAB9ACYP2C19MAPT
SCHEMBL3560869 0.88 SMN1; SMN2 (0.67) SMN1; SMN2NPC1RAB9ACYP2C19MAPT
SCHEMBL4756904 0.87 RAB9A (0.60) SMN1; SMN2NPC1RAB9ACYP2C19MAPT
SCHEMBL17307104 0.86 NPC1 (0.59) SMN1; SMN2NPC1RAB9ACYP2C19MAPT
SCHEMBL10917021 0.85 FABP7 (0.58) SMN1; SMN2NPC1RAB9ACYP2C19KMT2A
SCHEMBL280126 0.85 FABP7 (0.58) SMN1; SMN2NPC1RAB9ACYP2C19KMT2A
SCHEMBL6666657 0.85 FABP7 (0.58) SMN1; SMN2NPC1RAB9ACYP2C19KMT2A
SCHEMBL3096459 0.85 POLB (0.55) SMN1; SMN2NPC1RAB9ACYP2C19MEN1
SCHEMBL3409075 0.85 SMN1; SMN2 (0.57) SMN1; SMN2NPC1RAB9ACYP2C19MAPT
SCHEMBL13287204 0.85 SMN1; SMN2 (0.57) SMN1; SMN2NPC1RAB9ACYP2C19MAPT

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 70 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2026103814-A1 IRREVERSIBLE FAP INHIBITOR AND USE THEREOF 南京科络思生物科技有限公司 2026-05-21 WO disclosed
CN-110256489-B Preparation method of alkyl phosphonyl 苏州大学 2022-03-08 CN disclosed
EP-3626716-A1 ANTIVIRAL COMPOUNDS Gilead Pharmasset LLC (US) 2020-03-25 EP disclosed
US-9981955-B2 Antiviral compounds GILEAD PHARMASSET LLC (US) 2018-05-29 US disclosed
EP-3309157-A1 ANTIVIRAL COMPOUNDS Gilead Pharmasset LLC (US) 2018-04-18 EP disclosed
EP-3002281-B1 ANTIVIRAL COMPOUNDS GILEAD PHARMASSET LLC (US) 2017-09-13 EP disclosed
US-9662339-B2 Benzodioxane inhibitors of leukotriene production for combination therapy BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2017-05-30 US disclosed
EP-2822941-B1 BENZODIOXANES IN COMBINATION WITH STATINS FOR INHIBITING LEUKOTRIENE PRODUCTION BOEHRINGER INGELHEIM INT (DE) 2017-05-10 EP disclosed
EP-2822942-B1 BENZODIOXANES FOR INHIBITING LEUKOTRIENE PRODUCTION BOEHRINGER INGELHEIM INT (DE) 2017-05-10 EP disclosed
US-20170029408-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. 2017-02-02 US disclosed
EP-0828754-B1 DIPEPTIDES WHICH PROMOTE RELEASE OF GROWTH HORMONE PFIZER (US) 2005-02-02 EP disclosed
US-20040254178-A1 Substituted heterocyclic compounds and methods of use AMGEN INC. 2004-12-16 US disclosed
WO-2004094379-A2 3-PHENYL-4- (PYRIMIDIN-2-YL) -6- (PIPERIDIN-4-YL) DERIVATIVES AND RELATED COMPOUNDS AS TNF-ALPHA AND IL-1 INHIBITORS FOR THE TREATMENT OF INFLAMMATIONS AMGEN INC. (US) 2004-11-04 WO disclosed
US-20040198755-A1 Bicyclic nitrogen-containing heterocyclic derivatives for use as antibacterials SMITHKLINE BEECHAM P.L.C. (GB) 2004-10-07 US disclosed
EP-1392686-A1 BICYCLIC NITROGEN-CONTAINING HETEROCYCLIC DERIVATIVES FOR USE AS ANTIBACTERIALS SMITHKLINE BEECHAM PLC (GB) 2004-03-03 EP disclosed
WO-2003099808-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2003-12-04 WO disclosed
WO-2002096907-A1 BICYCLIC NITROGEN-CONTAINING HETEROCYCLIC DERIVATIVES FOR USE AS ANTIBACTERIALS SMITHKLINE BEECHAM P.L.C. (GB) 2002-12-05 WO disclosed
EP-1115731-A2 NOVEL PYRANOSES Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 2001-07-18 EP disclosed
WO-2000014097-A2 NOVEL PYRANOSES BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 2000-03-16 WO disclosed
US-5936089-A PIPERIDINE DERIVATIVES; BONE DISORDERS; OBESITY; AGING; CACHEXIA ASSOCIATED WITH AIDS AND CANCER PFIZER INC (US) 1999-08-10 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170029408-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, ZC3HAV1 SMN1; SMN2 1564/4885NPC1 516/4885RAB9A 1694/4885
US-20040198755-A1 Bicyclic nitrogen-containing heterocyclic derivatives for use as antibacterials NRDC, NUCB2, ASNS SMN1; SMN2 1149/4885NPC1 961/4885RAB9A 1925/4885
US-20040254178-A1 Substituted heterocyclic compounds and methods of use MYLK2, MAPT, MUSK SMN1; SMN2 9/4885NPC1 2806/4885RAB9A 890/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.