SCHEMBL4549849

SCHEMBL4549849

CN1CCn2c(cc3cnc(Nc4ccc(N5CCNCC5)cn4)nc32)C1=O

nearest known ligand 0.75

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 8/20 0.75
CCND1 P24385 8/20 0.75
CDK2 P24941 18/20 0.69
CCNE1 P24864 15/20 0.69
CCND3 P30281 2/20 0.61
CDK6 Q00534 1/20 0.61
CCNA2 P20248 2/20 0.58
CCND2 P30279 1/20 0.58
CCNA1 P78396 1/20 0.58
FGFR1 P11362 1/20 0.57
FGFR2 P21802 1/20 0.57
FGFR4 P22455 1/20 0.57
FGFR3 P22607 1/20 0.57

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
SCHEMBL20842267 0.96 CDK4 (0.70) CDK4CCND1CDK2CCNE1CCND3
SCHEMBL20842272 0.90 CDK4 (0.75) CDK4CCND1CDK2CCNE1CCND3
SCHEMBL4549919 0.85 CDK4 (1.00) CDK4CCND1CDK2CCNE1CCND3
SCHEMBL10082060 0.83 CDK2 (0.77) CDK4CCND1CDK2CCNE1CCND3
SCHEMBL18494400 0.83 CDK2 (0.77) CDK4CCND1CDK2CCNE1CCND3
SCHEMBL15249270 0.82 CDK2 (0.73) CDK4CCND1CDK2CCNE1CCND3
SCHEMBL23474803 0.82 CDK4 (0.86) CDK4CCND1CDK2CCNE1CCND3
SCHEMBL25949667 0.82 CDK4 (0.93) CDK4CCND1CDK2CCNE1CCND3
SCHEMBL15249235 0.82 CDK4 (0.56) CDK4CCND1CDK2CCNE1CCND3
SCHEMBL15249262 0.82 CDK2 (1.00) CDK4CCND1CDK2CCNE1CCND3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230381189-A1 TRANSIENT PROTECTION OF NORMAL CELLS DURING CHEMOTHERAPY G1 THERAPEUTICS, INC. (US) 2023-11-30 US disclosed
US-20230381189-A1 TRANSIENT PROTECTION OF NORMAL CELLS DURING CHEMOTHERAPY G1 THERAPEUTICS, INC. (US) 2023-11-30 US disclosed
US-20230364098-A1 HSPC-SPARING TREATMENTS FOR RB-POSITIVE ABNORMAL CELLULAR PROLIFERATION G1 THERAPEUTICS, INC. (US) 2023-11-16 US disclosed
US-20230364098-A1 HSPC-SPARING TREATMENTS FOR RB-POSITIVE ABNORMAL CELLULAR PROLIFERATION G1 THERAPEUTICS, INC. (US) 2023-11-16 US disclosed
US-20230248733-A1 HIGHLY ACTIVE ANTI-NEOPLASTIC AND ANTI-PROLIFERATIVE AGENTS G1 THERAPEUTICS, INC. (US) 2023-08-10 US disclosed
US-11717523-B2 Transient protection of normal cells during chemotherapy G1 THERAPEUTICS, INC. (US) 2023-08-08 US disclosed
US-11717523-B2 Transient protection of normal cells during chemotherapy G1 THERAPEUTICS, INC. (US) 2023-08-08 US disclosed
US-20230241059-A1 ANTI-NEOPLASTIC COMBINATIONS AND DOSING REGIMENS USING CDK4/6 INHIBITOR COMPOUNDS TO TREAT RB-POSITIVE TUMORS G1 THERAPEUTICS, INC. (US) 2023-08-03 US disclosed
US-20230241059-A1 ANTI-NEOPLASTIC COMBINATIONS AND DOSING REGIMENS USING CDK4/6 INHIBITOR COMPOUNDS TO TREAT RB-POSITIVE TUMORS G1 THERAPEUTICS, INC. (US) 2023-08-03 US disclosed
US-11654148-B2 HSPC-sparing treatments for RB-positive abnormal cellular proliferation G1 THERAPEUTICS, INC. (US) 2023-05-23 US disclosed
US-8822683-B2 CDK inhibitors G1 THERAPEUTICS, INC. (US) 2014-09-02 US disclosed
US-20140142299-A1 CDK Inhibitors G1 THERAPEUTICS, INC. (US) 2014-05-22 US disclosed
US-20140142299-A1 CDK Inhibitors G1 THERAPEUTICS, INC. (US) 2014-05-22 US disclosed
US-20140142306-A1 CDK Inhibitors G1 THERAPEUTICS, INC. (US) 2014-05-22 US disclosed
US-20140142306-A1 CDK Inhibitors G1 THERAPEUTICS, INC. (US) 2014-05-22 US disclosed
US-20130237534-A1 CDK INHIBITORS G1 THERAPEUTICS, INC. (US) 2013-09-12 US disclosed
US-20130237534-A1 CDK INHIBITORS G1 THERAPEUTICS, INC. (US) 2013-09-12 US disclosed
US-20130237544-A1 CDK INHIBITORS G1 THERAPEUTICS, INC. (US) 2013-09-12 US disclosed
US-20130237544-A1 CDK INHIBITORS G1 THERAPEUTICS, INC. (US) 2013-09-12 US disclosed
WO-2012061156-A1 CDK INHIBITORS TAVARES FRANCIS X (US) 2012-05-10 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 (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-20130237534-A1 CDK INHIBITORS CDK3, CDK9, CDK6 CDK4 12/4885CCND1 47/4885CDK2 5/4885
US-20230364098-A1 HSPC-SPARING TREATMENTS FOR RB-POSITIVE ABNORMAL CELLULAR PROLIFERATION RB1, CDK4, CDKN1A CDK4 2/4885CCND1 84/4885CDK2 13/4885
US-20230248733-A1 HIGHLY ACTIVE ANTI-NEOPLASTIC AND ANTI-PROLIFERATIVE AGENTS MKI67, PCNA, HRAS CDK4 16/4885CCND1 36/4885CDK2 69/4885
US-20230381189-A1 TRANSIENT PROTECTION OF NORMAL CELLS DURING CHEMOTHERAPY CDK6, CCNC, MCL1 CDK4 6/4885CCND1 41/4885CDK2 10/4885
US-20140142306-A1 CDK Inhibitors CDK3, CDK9, CDK6 CDK4 12/4885CCND1 47/4885CDK2 5/4885
US-20230241059-A1 ANTI-NEOPLASTIC COMBINATIONS AND DOSING REGIMENS USING CDK4/6 INHIBITOR COMPOUNDS TO TREAT RB-POSITIVE TUMORS CDK4, RB1, BTK CDK4 1/4885CCND1 47/4885CDK2 16/4885
US-20140142299-A1 CDK Inhibitors CDK3, CDK9, CDK6 CDK4 12/4885CCND1 47/4885CDK2 5/4885
US-11654148-B2 HSPC-sparing treatments for RB-positive abnormal cellular proliferation RB1, CDK4, CDKN1A CDK4 2/4885CCND1 84/4885CDK2 13/4885
US-11717523-B2 Transient protection of normal cells during chemotherapy CDK6, CCNC, MCL1 CDK4 6/4885CCND1 41/4885CDK2 10/4885
US-20130237544-A1 CDK INHIBITORS CDK3, CDK9, CDK6 CDK4 12/4885CCND1 47/4885CDK2 5/4885

“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.