SCHEMBL666139

SCHEMBL666139

CN1CCC(c2c(O)cc(O)c3c(=O)cc(-c4ccccc4Cl)oc23)C1(C)O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 13/20 0.65
CDK1 P06493 12/20 0.65
CCND1 P24385 11/20 0.65
CDK2 P24941 10/20 0.65
CDK9 P50750 10/20 0.65
CCNB1 P14635 9/20 0.65
CCNT1 O60563 8/20 0.65
CCNB2 O95067 7/20 0.65
CCNB3 Q8WWL7 7/20 0.65
CCNA2 P20248 6/20 0.65
CCNE1 P24864 5/20 0.65
GSK3A P49840 4/20 0.65
CDK7 P50613 3/20 0.65
CCND3 P30281 3/20 0.65
CDK6 Q00534 3/20 0.65
CCNH P51946 2/20 0.65
MNAT1 P51948 2/20 0.65
MAPK15 Q8TD08 2/20 0.65
CAMKK2 Q96RR4 2/20 0.65
CCNA1 P78396 2/20 0.65

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
Hydrochloric Acid SCHEMBL665647 0.99 CDK4 (0.66) CDK4CDK1CCND1CDK2CDK9
SCHEMBL14694365 0.88 CDK2 (0.53) CDK4CDK1CCND1CDK2CDK9
SCHEMBL3108179 0.87 CDK2 (0.51) CDK4CDK1CCND1CDK2CDK9
Hydrochloric Acid SCHEMBL3119657 0.86 CDK4 (0.51) CDK4CDK1CCND1CDK2CDK9
SCHEMBL2446327 0.86 CDK4 (0.68) CDK4CDK1CCND1CDK2CDK9
SCHEMBL30688746 0.86 CDK4 (0.68) CDK4CDK1CCND1CDK2CDK9
Hydrochloric Acid SCHEMBL31632765 0.85 CDK4 (0.67) CDK4CDK1CCND1CDK2CDK9
Hydrochloric Acid SCHEMBL4015958 0.85 CDK4 (0.67) CDK4CDK1CCND1CDK2CDK9
Hydrochloric Acid SCHEMBL30688749 0.85 CDK4 (0.67) CDK4CDK1CCND1CDK2CDK9
SCHEMBL23788690 0.85 CDK4 (0.67) CDK4CDK1CCND1CDK2CDK9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12383530-B2 Pharmaceutical combination for the treatment of melanoma Piramal Enterprises Limited (IN) 2025-08-12 US disclosed
US-20240165076-A1 PHARMACEUTICAL COMBINATION FOR THE TREATMENT OF MELANOMA Piramal Enterprises Limited (IN) 2024-05-23 US disclosed
US-11839591-B2 Pharmaceutical combination for the treatment of melanoma Piramal Enterprises Limited (IN) 2023-12-12 US disclosed
US-20210393589-A1 PHARMACEUTICAL COMBINATION FOR THE TREATMENT OF MELANOMA Piramal Enterprises Limited (IN) 2021-12-23 US disclosed
US-11007174-B2 Pharmaceutical combination for the treatment of melanoma Piramal Enterprises Limited (IN) 2021-05-18 US disclosed
US-20190282544-A1 PHARMACEUTICAL COMBINATION FOR THE TREATMENT OF MELANOMA Piramal Enterprises Limited (IN) 2019-09-19 US disclosed
EP-3019166-B1 A PHARMACEUTICAL COMBINATION FOR THE TREATMENT OF MELANOMA PIRAMAL ENTPR LTD (IN) 2019-05-08 EP disclosed
EP-2427188-B1 PYRROLIDINE-SUBSTITUTED FLAVONES AS RADIO-SENSITIZERS FOR USE IN THE TREATMENT OF CANCER PIRAMAL ENTPR LTD (IN) 2016-08-10 EP disclosed
US-20160136132-A1 A PHARMACEUTICAL COMBINATION FOR THE TREATMENT OF MELANOMA Piramal Enterprises Limited (IN) 2016-05-19 US disclosed
US-8895605-B2 Pyrrolidine-substituted flavones as radio-sensitizers for use in the treatment of cancer Piramal Enterprises Limited (IN) 2014-11-25 US disclosed
EP-2802323-A1 PYRROLIDINE- SUBSTITUTED FLAVONE DERIVATIVES FOR PREVENTION OR TREATMENT OF ORAL MUCOSITIS Piramal Enterprises Limited (IN) 2014-11-19 EP disclosed
WO-2014140695-A1 SOLID ORAL FORMULATION OF A PYRROLIDINE SUBSTITUTED FLAVONE COMPOUND Piramal Enterprises Limited (IN) 2014-09-18 WO disclosed
WO-2013105056-A1 PYRROLIDINE- SUBSTITUTED FLAVONE DERIVATIVES FOR PREVENTION OR TREATMENT OF ORAL MUCOSITIS Piramal Enterprises Limited (IN) 2013-07-18 WO disclosed
US-20120046334-A1 PYRROLIDINE-SUBSTITUTED FLAVONES AS RADIO-SENSITIZERS FOR USE IN THE TREATMENT OF CANCER Piramal Enterprises Limited (IN) 2012-02-23 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 (8 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-12383530-B2 Pharmaceutical combination for the treatment of melanoma BRAF, CCNI, CDK1 CDK4 4/4885CDK1 3/4885CCND1 55/4885
US-20160136132-A1 A PHARMACEUTICAL COMBINATION FOR THE TREATMENT OF MELANOMA BRAF, CDK1, CCNI CDK4 4/4885CDK1 2/4885CCND1 57/4885
US-20120046334-A1 PYRROLIDINE-SUBSTITUTED FLAVONES AS RADIO-SENSITIZERS FOR USE IN THE TREATMENT OF CANCER CCNI, CCNK, CDK3 CDK4 21/4885CDK1 13/4885CCND1 10/4885
US-11839591-B2 Pharmaceutical combination for the treatment of melanoma BRAF, CCNI, CDK1 CDK4 4/4885CDK1 3/4885CCND1 55/4885
US-20190282544-A1 PHARMACEUTICAL COMBINATION FOR THE TREATMENT OF MELANOMA BRAF, CCNI, CDK1 CDK4 4/4885CDK1 3/4885CCND1 55/4885
US-11007174-B2 Pharmaceutical combination for the treatment of melanoma BRAF, CCNI, CDK1 CDK4 4/4885CDK1 3/4885CCND1 55/4885
US-20210393589-A1 PHARMACEUTICAL COMBINATION FOR THE TREATMENT OF MELANOMA BRAF, CCNI, CDK1 CDK4 4/4885CDK1 3/4885CCND1 55/4885
US-20240165076-A1 PHARMACEUTICAL COMBINATION FOR THE TREATMENT OF MELANOMA BRAF, CDK1, CDK6 CDK4 15/4885CDK1 2/4885CCND1 172/4885

“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.