SCHEMBL3759574

SCHEMBL3759574

Nc1ccn([C@]2(F)O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]2F)c(=O)n1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLA1 P09884 2/20 0.44
POLB P06746 1/20 0.42
P2RY2 P41231 5/20 0.40
TSHR P16473 1/20 0.40
GLA P06280 1/20 0.40
PDE4D Q08499 1/20 0.39
PDE3A Q14432 1/20 0.39
SLC29A1 Q99808 1/20 0.39
P2RY6 Q15077 3/20 0.38
P2RY4 P51582 2/20 0.37
ADSS2 P30520 1/20 0.37
ST6GAL1 P15907 2/20 0.37
LMNA P02545 1/20 0.36
THRB P10828 1/20 0.36
MTOR P42345 1/20 0.36
MDM2 Q00987 1/20 0.36
NCOA1 Q15788 1/20 0.36
NCOA3 Q9Y6Q9 1/20 0.36
POLG P54098 1/20 0.36

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
SCHEMBL4257981 0.92 POLG (0.46) POLA1POLBP2RY2P2RY6P2RY4
SCHEMBL30194983 0.92 POLA1 (0.46) POLA1POLBP2RY2TSHRGLA
SCHEMBL4254632 0.91 POLG (0.49) POLA1POLBP2RY2P2RY6P2RY4
SCHEMBL582792 0.84 PDE3A (0.52) POLA1POLBTSHRGLAPDE4D
SCHEMBL350552 0.84 PDE3A (0.52) POLA1POLBTSHRGLAPDE4D
SCHEMBL19644955 0.82 PDE4D (0.38) POLA1POLBP2RY2TSHRGLA
SCHEMBL9515900 0.81 POLB (0.43) POLA1POLBP2RY2TSHRGLA
SCHEMBL12354843 0.81 POLA1 (0.44) POLA1POLBP2RY2TSHRGLA
SCHEMBL12363580 0.81 POLA1 (0.44) POLA1POLBP2RY2TSHRGLA
SCHEMBL13234931 0.81 POLA1 (0.44) POLA1POLBP2RY2TSHRGLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114306240-A Gemcitabine or liposome of salt thereof, preparation method and application thereof 四川科伦药物研究院有限公司 2022-04-12 CN disclosed
US-20160324885-A1 COMPOSITION CONTAINING MODIFIED DERIVATIVES OF A CYTIDINE ANTIMETABOLITE FOR THE TREATMENT OF SUSCEPTIBLE DISEASE ASTERIAPHARMA GMBH (DE) 2016-11-10 US disclosed
EP-2854864-B1 COMPOSITIONS COMPRISING OLIGOMERS OF GEMCITABINE FOR USE IN THERAPY ASTERIAPHARMA GMBH (DE) 2016-05-04 EP disclosed
EP-2854864-A1 COMPOSITION CONTAINING MODIFIED DERIVATIVES OF A CYTIDINE ANTIMETABOLITE FOR THE TREATMENT OF SUSCEPTIBLE DISEASE Asteriapharma GmbH (DE) 2015-04-08 EP disclosed
WO-2015003747-A1 COMPOSITION CONTAINING MODIFIED DERIVATIVES OF A CYTIDINE ANTIMETABOLITE FOR THE TREATMENT OF SUSCEPTIBLE DISEASE ASTERIAPHARMA GMBH (DE) 2015-01-15 WO disclosed
US-8388966-B2 Combination treatment of pancreatic cancer CANCER ADVANCES, INC. (US) 2013-03-05 US disclosed
US-20100311606-A1 PHARMACOGENOMIC CELL LINE PANEL AND USE THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2010-12-09 US disclosed
US-20090004200-A1 Combination treatment of pancreatic cancer CANCER ADVANCES, INC. 2009-01-01 US disclosed
WO-2008137907-A1 PHARMACOGENOMIC CELL LINE PANEL AND USE THEREOF MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2008-11-13 WO disclosed
US-20060140962-A1 Combination treatment of pancreatic cancer CANCER ADVANCES, INC. 2006-06-29 US disclosed
EP-1372717-A2 COMBINATION TREATMENT OF PANCREATIC CANCER APHTON CORPORATION (US) 2004-01-02 EP disclosed
US-20030091574-A1 Combination treatment of pancreatic cancer CANCER ADVANCES, INC. 2003-05-15 US disclosed
WO-2002076499-A2 COMBINATION TREATMENT OF PANCREATIC CANCER APHTON CORPORATION (US) 2002-10-03 WO 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 (1 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-20160324885-A1 COMPOSITION CONTAINING MODIFIED DERIVATIVES OF A CYTIDINE ANTIMETABOLITE FOR THE TREATMENT OF SUSCEPTIBLE DISEASE DCTD, TYMP, CDA POLA1 224/4885POLB 125/4885P2RY2 2007/4885

“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.