SCHEMBL1720432

SCHEMBL1720432

CCCn1c(Cl)nc2nc(-c3ccco3)[nH]c2c1=O

nearest known ligand 0.68

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 8/20 0.51
ADORA2B P29275 8/20 0.51
ADORA3 P0DMS8 4/20 0.47
ADORA1 P30542 3/20 0.47
KDM4E B2RXH2 3/20 0.45
ALDH1A1 P00352 3/20 0.45
MEN1 O00255 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
KMT2A Q03164 1/20 0.45
HSD17B10 Q99714 1/20 0.45
GAA P10253 2/20 0.44
HPGD P15428 2/20 0.44
MAPT P10636 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL2686441 0.86 ADORA2B (0.52) ADORA2AADORA2BADORA3ADORA1KDM4E
SCHEMBL8872400 0.81 ADORA2B (0.69) ADORA2AADORA2BADORA1KDM4EALDH1A1
SCHEMBL1720857 0.76 ALDH1A1 (0.45) ADORA2AADORA2BADORA3ADORA1KDM4E
SCHEMBL1725022 0.75 ADORA2B (0.46) ADORA2AADORA2BADORA3ADORA1ALDH1A1
SCHEMBL2687515 0.75 ADORA2B (0.46) ADORA2AADORA2BADORA3ADORA1KDM4E
SCHEMBL1727456 0.75 ADORA2B (0.53) ADORA2AADORA2BADORA3ADORA1
SCHEMBL1724477 0.74 ADORA2B (0.50) ADORA2AADORA2BADORA3ADORA1
SCHEMBL2685902 0.73 ADORA2B (0.64) ADORA2AADORA2BADORA3ADORA1
SCHEMBL21153880 0.73 ADORA2B (0.49) ADORA2AADORA2BADORA1
SCHEMBL1724001 0.72 ADORA2B (0.72) ADORA2AADORA2BADORA3ADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240307402-A1 PHARMACEUTICAL COMPOSITION FOR THE TREATMENT OF CANCER IMPETIS BIOSCIENCES LTD. (IN) 2024-09-19 US claimed
CN-118001282-A Pharmaceutical composition for cancer treatment 因佩蒂斯生物科学有限公司 2024-05-10 CN claimed
EP-3727391-A1 PHARMACEUTICAL COMPOSITION FOR THE TREATMENT OF CANCER Impetis Biosciences Ltd. (IN) 2020-10-28 EP claimed
CN-111801099-A Pharmaceutical composition for cancer treatment 因佩蒂斯生物科学有限公司 2020-10-20 CN claimed
US-20200316077-A1 PHARMACEUTICAL COMPOSITION FOR THE TREATMENT OF CANCER IMPETIS BIOSCIENCES LTD. (IN) 2020-10-08 US claimed
US-20150087643-A1 Substituted Fused Pyrimidine Compounds ADVINUS THERAPEUTICS PRIVATE LIMITED (IN) 2015-03-26 US claimed
US-20120115864-A1 Substituted Fused Pyrimidine Compounds ADVINUS THERAPEUTICS LIMITED (IN) 2012-05-10 US claimed
EP-2405917-A2 SUBSTITUTED FUSED PYRIMIDINE COMPOUNDS Advinus Therapeutics Private Limited (IN) 2012-01-18 EP claimed
WO-2010103547-A2 SUBSTITUTED FUSED PYRIMIDINE COMPOUNDS ADVINUS THERAPEUTICS PRIVATE LIMITED (IN) 2010-09-16 WO claimed
US-20240307402-A1 PHARMACEUTICAL COMPOSITION FOR THE TREATMENT OF CANCER IMPETIS BIOSCIENCES LTD. (IN) 2024-09-19 US disclosed
CN-118001282-A Pharmaceutical composition for cancer treatment 因佩蒂斯生物科学有限公司 2024-05-10 CN disclosed
EP-3727391-A1 PHARMACEUTICAL COMPOSITION FOR THE TREATMENT OF CANCER Impetis Biosciences Ltd. (IN) 2020-10-28 EP disclosed
CN-111801099-A Pharmaceutical composition for cancer treatment 因佩蒂斯生物科学有限公司 2020-10-20 CN disclosed
US-20200316077-A1 PHARMACEUTICAL COMPOSITION FOR THE TREATMENT OF CANCER IMPETIS BIOSCIENCES LTD. (IN) 2020-10-08 US disclosed
US-9284316-B2 Substituted fused pyrimidine compounds ADVINUS THERAPEUTICS PRIVATE LIMITED (IN) 2016-03-15 US disclosed
US-20150087643-A1 Substituted Fused Pyrimidine Compounds ADVINUS THERAPEUTICS PRIVATE LIMITED (IN) 2015-03-26 US disclosed
US-8859566-B2 Substituted fused pyrimidine compounds ADVINUS THERAPEUTICS PRIVATE LIMITED (IN) 2014-10-14 US disclosed
US-20120115864-A1 Substituted Fused Pyrimidine Compounds ADVINUS THERAPEUTICS LIMITED (IN) 2012-05-10 US disclosed
EP-2405917-A2 SUBSTITUTED FUSED PYRIMIDINE COMPOUNDS Advinus Therapeutics Private Limited (IN) 2012-01-18 EP disclosed
WO-2010103547-A2 SUBSTITUTED FUSED PYRIMIDINE COMPOUNDS ADVINUS THERAPEUTICS PRIVATE LIMITED (IN) 2010-09-16 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 (4 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-20200316077-A1 PHARMACEUTICAL COMPOSITION FOR THE TREATMENT OF CANCER ADORA2B, ADORA2A, ADORA3 ADORA2A 2/4885ADORA2B 1/4885ADORA3 3/4885
US-20120115864-A1 Substituted Fused Pyrimidine Compounds ADORA2A, ADORA1, ADORA3 ADORA2A 1/4885ADORA2B 4/4885ADORA3 3/4885
US-20150087643-A1 Substituted Fused Pyrimidine Compounds ADORA2A, ADORA1, ADORA3 ADORA2A 1/4885ADORA2B 4/4885ADORA3 3/4885
US-20240307402-A1 PHARMACEUTICAL COMPOSITION FOR THE TREATMENT OF CANCER ADORA2B, ADORA2A, ADORA3 ADORA2A 2/4885ADORA2B 1/4885ADORA3 3/4885

“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.