SCHEMBL3698937

SCHEMBL3698937

CCCCC(CC(=O)O)N(Cc1ccccc1)[C@@H](C)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.43
CNR2 P34972 2/20 0.41
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
CA12 O43570 1/20 0.38
CA9 Q16790 1/20 0.38
MMP2 P08253 9/20 0.37
MMP1 P03956 4/20 0.37
MMP3 P08254 4/20 0.37

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
SCHEMBL2847080 1.00 POLB (0.43) POLBCNR2MEN1KMT2ACA12
SCHEMBL15608798 1.00 POLB (0.43) POLBCNR2MEN1KMT2ACA12
SCHEMBL20212169 1.00 POLB (0.43) POLBCNR2MEN1KMT2ACA12
SCHEMBL18109669 1.00 POLB (0.43) POLBCNR2MEN1KMT2ACA12
SCHEMBL2846748 0.94 POLB (0.39) POLBCNR2MEN1KMT2ACA12
SCHEMBL4205630 0.90 POLB (0.40) POLBCNR2MEN1KMT2AMMP2
SCHEMBL4205633 0.90 POLB (0.40) POLBCNR2MEN1KMT2AMMP2
SCHEMBL8624830 0.88 POLB (0.42) POLBCNR2MEN1KMT2A
SCHEMBL7376886 0.88 POLB (0.42) POLBCNR2MEN1KMT2A
SCHEMBL7373925 0.88 POLB (0.42) POLBCNR2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12377100-B2 Toll like receptor modulator compounds GILEAD SCIENCES, INC. (US) 2025-08-05 US disclosed
CN-112174960-B Toll-like receptor modulating 4, 6-diamino-pyrido [3,2-D ] pyrimidine compounds 吉利德科学公司 2023-10-10 CN disclosed
CN-110177780-B Pyrimidine compounds containing acidic groups 阿普罗斯治疗公司 2022-11-01 CN disclosed
US-20220305115-A1 COMBINATION OF HEPATITIS B VIRUS (HBV) VACCINES AND PYRIDOPYRIMIDINE DERIVATIVES Janssen Sciences Ireland Unlimited Company (IE) 2022-09-29 US disclosed
US-20220218709-A1 TOLL LIKE RECEPTOR MODULATOR COMPOUNDS GILEAD SCIENCES, INC. 2022-07-14 US disclosed
EP-3548478-B1 PYRIMIDINE COMPOUNDS CONTAINING ACIDIC GROUPS APROS THERAPEUTICS INC (US) 2021-11-17 EP disclosed
US-11173157-B2 Substituted pyrimidines containing acidic groups as TLR7 modulators Apros Therapeutics, Inc. (US) 2021-11-16 US disclosed
US-20210228713-A1 TLR7 PEPTIDE CONJUGATES Apros Therapeutics, Inc. 2021-07-29 US disclosed
CN-112512590-A TLR7 peptide conjugates 阿普罗斯治疗公司 2021-03-16 CN disclosed
CN-112513031-A Acid group containing pyrimidine compounds useful for the treatment of diseases associated with the modulation of TLR7 阿普罗斯治疗公司 2021-03-16 CN disclosed
US-9533978-B2 Pyrimidine derivatives and their use in the treatment of cancer and further diseases SUMITOMO DAINIPPON PHARMA CO., LTD (JP) 2017-01-03 US disclosed
EP-3097102-A1 TOLL-LIKE RECEPTOR MODULATING 4,6-DIAMINO-PYRIDO[3,2-D]PYRIMIDINE COMPOUNDS Gilead Sciences, Inc. (US) 2016-11-30 EP disclosed
US-20160289229-A1 TOLL LIKE RECEPTOR MODULATOR COMPOUNDS GILEAD SCIENCES, INC. 2016-10-06 US disclosed
US-20150080396-A1 Novel Pyrimidine Derivatives and Their Use in the Treatment of Cancer and Further Diseases DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2015-03-19 US disclosed
US-8765939-B2 Pyrimidline derivatives having immune modulating properties that act via TLR7 for the treatment of viral or allergic diseases and cancers ASTRAZENECA AB (SE) 2014-07-01 US disclosed
US-20130045955-A1 NOVEL COMPOUNDS BENNETT NICHOLAS J (GB) 2013-02-21 US disclosed
EP-2222648-B1 PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF ASTHMA, COPD, ALLERGIC RHINITIS, ALLERGIC CONJUNCTIVITIS, ATOPIC DERMATITIS, CANCER, HEPATITIS B, HEPATITIS C, HIV, HPV, BACTERIAL INFECTIONS AND DERMATOSIS ASTRAZENECA AB (SE) 2013-01-09 EP disclosed
US-8268990-B2 Compounds ASTRAZENECA AB (SE) 2012-09-18 US disclosed
US-20120122867-A1 NOVEL PYRIMIDINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF CANCER AND FURTHER DISEASES ASTRAZENECA UK LIMITED (GB) 2012-05-17 US disclosed
US-20090209524-A1 Novel Compounds ASTRAZENECA AB (SE) 2009-08-20 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 (10 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-20120122867-A1 NOVEL PYRIMIDINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF CANCER AND FURTHER DISEASES TYMS, TYMP, DPYD POLB 119/4885CNR2 1530/4885MEN1 2396/4885
US-20220218709-A1 TOLL LIKE RECEPTOR MODULATOR COMPOUNDS TLR8, TLR3, TLR6 POLB 2230/4885CNR2 357/4885MEN1 4835/4885
US-20210228713-A1 TLR7 PEPTIDE CONJUGATES TLR7, TLR9, TLR8 POLB 1712/4885CNR2 3479/4885MEN1 3950/4885
US-20150080396-A1 Novel Pyrimidine Derivatives and Their Use in the Treatment of Cancer and Further Diseases TYMS, TYMP, DPYD POLB 119/4885CNR2 1530/4885MEN1 2396/4885
US-20090209524-A1 Novel Compounds ABCG2, CYP4B1, CYP3A4 POLB 4672/4885CNR2 248/4885MEN1 595/4885
US-20130045955-A1 NOVEL COMPOUNDS ABCG2, F12, CFTR POLB 4515/4885CNR2 208/4885MEN1 805/4885
US-12377100-B2 Toll like receptor modulator compounds TLR8, TLR3, TLR6 POLB 2230/4885CNR2 357/4885MEN1 4835/4885
US-11173157-B2 Substituted pyrimidines containing acidic groups as TLR7 modulators TLR7, TLR9, MAVS POLB 652/4885CNR2 2438/4885MEN1 4690/4885
US-20160289229-A1 TOLL LIKE RECEPTOR MODULATOR COMPOUNDS TLR8, TLR3, TLR6 POLB 2230/4885CNR2 357/4885MEN1 4835/4885
US-20220305115-A1 COMBINATION OF HEPATITIS B VIRUS (HBV) VACCINES AND PYRIDOPYRIMIDINE DERIVATIVES HAVCR2, ENTPD5, HMGB3 POLB 222/4885CNR2 2295/4885MEN1 4628/4885

“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.