SCHEMBL147641

SCHEMBL147641

Nc1nc2c(c(=O)[nH]1)NCN2COC(CO)CO

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 11/20 0.67
MEN1 O00255 1/20 0.48
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.48
CYP3A4 P08684 1/20 0.48
NFKB1 P19838 1/20 0.48
BLM P54132 1/20 0.48
VCP P55072 1/20 0.48
KMT2A Q03164 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
HIF1A Q16665 1/20 0.48
PDE3A Q14432 1/20 0.37
PNP P00491 1/20 0.33
NOS1 P29475 2/20 0.33
USP2 O75604 1/20 0.32
CASP7 P55210 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL9057761 0.92 HPRT1 (0.59) HPRT1MEN1ALDH1A1LMNACYP3A4
SCHEMBL7132437 0.89 HPRT1 (0.60) HPRT1MEN1ALDH1A1LMNACYP3A4
SCHEMBL8149575 0.86 HPRT1 (0.60) HPRT1MEN1ALDH1A1LMNACYP3A4
SCHEMBL2775722 0.85 HPRT1 (0.55) HPRT1MEN1ALDH1A1LMNACYP3A4
SCHEMBL10643032 0.85 HPRT1 (0.56) HPRT1MEN1ALDH1A1LMNACYP3A4
SCHEMBL336072 0.84 HPRT1 (0.55) HPRT1MEN1ALDH1A1LMNACYP3A4
Ammonia Solution, Strong SCHEMBL10901621 0.83 HPRT1 (0.54) HPRT1MEN1ALDH1A1LMNACYP3A4
Water SCHEMBL10601101 0.83 HPRT1 (0.54) HPRT1MEN1ALDH1A1LMNACYP3A4
SCHEMBL28646181 0.83 HPRT1 (0.75) HPRT1MEN1ALDH1A1LMNACYP3A4
SCHEMBL8896070 0.83 HPRT1 (0.74) HPRT1MEN1ALDH1A1LMNACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7205404-B1 Phosphorus-containing prodrugs METABASIS THERAPEUTICS, INC. (US) 2007-04-17 US claimed
US-6878728-B1 Inhibitors of aspartyl protease VERTEX PHARMACEUTICAL INCORPORATED (US) 2005-04-12 US claimed
US-6663858-B1 In Vivo gene transfer using implanted retroviral producer cells THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2003-12-16 US claimed
US-6663857-B1 In vivo gene transfer using implanted retroviral producer cells THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2003-12-16 US claimed
EP-1143935-A3 CONTROLLED-RELEASE BIOCOMPATIBLE OCULAR DRUG DELIVERY IMPLANT DEVICES AND METHODS Oculex Pharmaceuticals, Inc. (US) 2002-09-18 EP claimed
US-6331313-B1 DRUG CORE COVERED BY IMPERMEABLE POLYMERIC OUTER LAYER WHICH HAS ONE OR MORE ORIFICES THROUGH WHICH OCULAR FLUIDS MAY PASS TO CONTACT THE CORE AND DISSOLVE DRUG OCULEX PHARMACETICALS, INC. 2001-12-18 US claimed
EP-1143935-A2 CONTROLLED-RELEASE BIOCOMPATIBLE OCULAR DRUG DELIVERY IMPLANT DEVICES AND METHODS Oculex Pharmaceuticals, Inc. (US) 2001-10-17 EP claimed
WO-2001030323-A2 CONTROLLED-RELEASE BIOCOMPATIBLE OCULAR DRUG DELIVERY IMPLANT DEVICES AND METHODS OCULEX PHARMACEUTICALS, INC. (US) 2001-05-03 WO claimed
EP-0594223-B1 Combination of therapeutic nucleosides and further therapeutic agents. WELLCOME FOUND (GB) 2000-03-01 EP claimed
US-5529774-A In vivo transfer of the HSV-TK gene implanted retroviral producer cells THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1996-06-25 US claimed
EP-0291633-B1 USE OF 3'-AZIDO-3'-DEOXYTHYMIDINE IN THE TREATMENT OR PROPHYLAXIS OF HUMAN RETROVIRAL INFECTIONS THE WELLCOME FOUNDATION LIMITED (GB) 1992-11-04 EP claimed
US-4902678-A SYNERGISTIC MIXTURE; HERPES VIRUS INFECTIONS SYNTEX (U.S.A.) INC. (US) 1990-02-20 US claimed
EP-0119757-B1 GUANINE DERIVATIVES, COMPOSITIONS CONTAINING THEM, AND THEIR ANTI-VIRAL USE SYNTEX (U.S.A.) INC. (US) 1988-08-10 EP claimed
EP-0217580-A2 Therapeutic nucleosides THE WELLCOME FOUNDATION LIMITED (GB) 1987-04-08 EP claimed
EP-0109234-B1 COMPOSITIONS COMPRISING INTERFERON AND THEIR THERAPEUTIC USE SYNTEX (U.S.A.) INC. (US) 1987-04-01 EP claimed
EP-0101441-B1 ANTI-VIRAL COMPOSITIONS SYNTEX (U.S.A.) INC. (US) 1987-01-14 EP claimed
EP-0135713-A2 Antiviral combinations THE WELLCOME FOUNDATION LIMITED (GB) 1985-04-03 EP claimed
EP-0119757-A2 Guanine derivatives, compositions containing them, and their anti-viral use SYNTEX (U.S.A.) INC. (US) 1984-09-26 EP claimed
US-4462986-A INTERFERON AND 9-((2-HYDROXY-1-(HYDROXYMETHYL)-ETHOXY)METHYL)GUANINE ENS BIO LOGICALS, INC. (CA) 1984-07-31 US claimed
EP-0109234-A1 Compositions comprising interferon and their therapeutic use SYNTEX (U.S.A.) INC. (US) 1984-05-23 EP claimed