SCHEMBL20528275

SCHEMBL20528275

Fc1cnc(Nc2ccc(CN3CCN4CCC[C@@H]4C3)cn2)nc1-c1cc(F)c2nc3n(c2c1)[C@H](C(F)F)CC3

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 20/20 0.65
CCND3 P30281 20/20 0.65
CDK6 Q00534 16/20 0.65
CDK1 P06493 14/20 0.65
CCNA2 P20248 4/20 0.64
CCNT1 O60563 1/20 0.62
CCNE1 P24864 1/20 0.62
CDK2 P24941 1/20 0.62
CDK7 P50613 1/20 0.62
CDK9 P50750 1/20 0.62
CCNH P51946 1/20 0.62

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
SCHEMBL29686496 1.00 CDK4 (0.65) CDK4CCND3CDK6CDK1CCNA2
SCHEMBL21499040 1.00 CDK4 (0.65) CDK4CCND3CDK6CDK1CCNA2
SCHEMBL18191681 0.91 CDK4 (0.79) CDK4CCND3CDK6CDK1CCNA2
SCHEMBL20528183 0.91 CDK4 (0.79) CDK4CCND3CDK6CDK1CCNA2
SCHEMBL18191753 0.90 CDK4 (0.70) CDK4CCND3CDK6CDK1CCNA2
SCHEMBL29686798 0.90 CDK4 (0.70) CDK4CCND3CDK6CDK1CCNA2
SCHEMBL21499013 0.89 CDK4 (0.65) CDK4CCND3CDK6CDK1CCNA2
SCHEMBL18191696 0.89 CDK4 (0.65) CDK4CCND3CDK6CDK1CCNA2
SCHEMBL29686754 0.89 CDK4 (0.65) CDK4CCND3CDK6CDK1CCNA2
SCHEMBL18201881 0.88 CDK4 (0.69) CDK4CCND3CDK6CDK1CCNA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3288931-B2 CERTAIN PROTEIN KINASE INHIBITOR CHONGQING FOCHON PHARMACEUTICAL CO LTD (CN) 2022-07-20 EP claimed
CN-107849012-B Kinase inhibitor 重庆复创医药研究有限公司 2021-05-25 CN claimed
EP-3288931-B1 CERTAIN PROTEIN KINASE INHIBITOR CHONGQING FOCHON PHARMACEUTICAL CO LTD (CN) 2019-11-06 EP claimed
US-10450316-B2 Certain protein kinase inhibitor Chongqing Fochon Pharmaceutical Co., Ltd. (CN) 2019-10-22 US claimed
US-20180291027-A1 CERTAIN PROTEIN KINASE INHIBITOR FOCHON BIOSCIENCES, LTD. (CN) 2018-10-11 US claimed
EP-3288931-B2 CERTAIN PROTEIN KINASE INHIBITOR CHONGQING FOCHON PHARMACEUTICAL CO LTD (CN) 2022-07-20 EP disclosed
US-11351170-B2 Substituted pyrimidines as CDK4/6 inhibitors BEIJING XUANYI PHARMASCIENCES CO., LTD. (CN) 2022-06-07 US disclosed
CN-107849012-B Kinase inhibitor 重庆复创医药研究有限公司 2021-05-25 CN disclosed
US-20210128555-A1 CDK4/6 INHIBITORS AND USE THEREOF BEIJING XUANYI PHARMASCIENCES CO., LTD. (CN) 2021-05-06 US disclosed
EP-3288931-B1 CERTAIN PROTEIN KINASE INHIBITOR CHONGQING FOCHON PHARMACEUTICAL CO LTD (CN) 2019-11-06 EP disclosed
US-10450316-B2 Certain protein kinase inhibitor Chongqing Fochon Pharmaceutical Co., Ltd. (CN) 2019-10-22 US disclosed
US-10450316-B2 Certain protein kinase inhibitor Chongqing Fochon Pharmaceutical Co., Ltd. (CN) 2019-10-22 US disclosed
US-20180291027-A1 CERTAIN PROTEIN KINASE INHIBITOR FOCHON BIOSCIENCES, LTD. (CN) 2018-10-11 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 (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-10450316-B2 Certain protein kinase inhibitor CDK4, CDK6, CDK2 CDK4 1/4885CCND3 96/4885CDK6 2/4885
US-11351170-B2 Substituted pyrimidines as CDK4/6 inhibitors CDK4, CDK6, CDK2 CDK4 1/4885CCND3 41/4885CDK6 2/4885
US-20180291027-A1 CERTAIN PROTEIN KINASE INHIBITOR CDK4, CDK6, CDK2 CDK4 1/4885CCND3 242/4885CDK6 2/4885
US-20210128555-A1 CDK4/6 INHIBITORS AND USE THEREOF CDK4, CDK6, CDK1 CDK4 1/4885CCND3 38/4885CDK6 2/4885

“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.