SCHEMBL1724896

SCHEMBL1724896

CCCn1cnc2nc(-c3ccc(OCC(=O)N4CCN(c5cccc(C(F)(F)F)c5)CC4)cc3)[nH]c2c1=O

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.57
LMNA P02545 1/20 0.55
MAPT P10636 1/20 0.55
HTT P42858 1/20 0.55
ADORA2B P29275 11/20 0.54
ADORA2A P29274 9/20 0.52
ADORA1 P30542 2/20 0.52
ADORA3 P0DMS8 1/20 0.51
RECQL P46063 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
ENPP2 Q13822 2/20 0.48
POLB P06746 2/20 0.48
PDE3B Q13370 1/20 0.48
PDE3A Q14432 1/20 0.48
HPGD P15428 1/20 0.47
HSD17B10 Q99714 1/20 0.47

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
SCHEMBL30891826 1.00 TSHR (0.57) TSHRLMNAMAPTHTTADORA2B
SCHEMBL30891847 0.79 ADORA2B (0.74) ADORA2BADORA2AADORA1
SCHEMBL2685092 0.79 ADORA2B (0.74) ADORA2BADORA2AADORA1
SCHEMBL30891840 0.77 ADORA2B (0.49) ADORA2BADORA2AADORA1ADORA3
SCHEMBL2686448 0.77 ADORA2B (0.49) ADORA2BADORA2AADORA1ADORA3
SCHEMBL1724762 0.76 ADORA2B (0.64) ADORA2BADORA2AADORA1ADORA3
SCHEMBL6512612 0.75 ADORA2A (0.84) ADORA2BADORA2AADORA1ADORA3
SCHEMBL15642880 0.74 ADORA2B (0.66) ADORA2BADORA2AADORA1ADORA3
SCHEMBL2686196 0.72 ADORA2B (0.42) ADORA2BADORA2AADORA1ADORA3
SCHEMBL1724494 0.71 ADORA2B (0.46) ADORA2BADORA2AADORA1ADORA3

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 19 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
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
EP-2405917-B1 SUBSTITUTED FUSED PYRIMIDINE COMPOUNDS ADVINUS THERAPEUTICS PRIVATE LTD (IN) 2014-04-23 EP 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 TSHR 85/4885LMNA 3569/4885MAPT 458/4885
US-20120115864-A1 Substituted Fused Pyrimidine Compounds ADORA2A, ADORA1, ADORA3 TSHR 871/4885LMNA 3615/4885MAPT 1194/4885
US-20150087643-A1 Substituted Fused Pyrimidine Compounds ADORA2A, ADORA1, ADORA3 TSHR 899/4885LMNA 3608/4885MAPT 1252/4885
US-20240307402-A1 PHARMACEUTICAL COMPOSITION FOR THE TREATMENT OF CANCER ADORA2B, ADORA2A, ADORA3 TSHR 85/4885LMNA 3569/4885MAPT 458/4885

“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.