SCHEMBL10082016

SCHEMBL10082016

CN1CCn2c(cc3cnc(Cl)nc32)C1=O

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
CDK4 P11802 2/20 0.34
CCND1 P24385 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
LRRK2 Q5S007 1/20 0.32
RPS6KA3 P51812 1/20 0.30
CCNE1 P24864 1/20 0.30
CDK2 P24941 1/20 0.30

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
SCHEMBL25949230 0.84 CYP2D6 (0.38) CYP2D6HRH3CDK4CCND1CCNE1
SCHEMBL25948790 0.78 SMN1; SMN2 (0.35) SMN1; SMN2
SCHEMBL4549832 0.75 CDK4 (0.50) CYP2D6HRH3CDK4CCND1RPS6KA3
SCHEMBL10082654 0.74 CDK2 (0.36) CDK4CCND1CCNE1CDK2
SCHEMBL18493528 0.74 CDK2 (0.36) CDK4CCND1CCNE1CDK2
SCHEMBL25950536 0.74 CRHR1 (0.31)
SCHEMBL30730837 0.74 HRH3 (0.41) CYP2D6HRH3
SCHEMBL23016499 0.73 RPS6KA3 (0.48) CDK4CCND1RPS6KA3
SCHEMBL15249220 0.71 CDK2 (0.41) CDK4CCND1CCNE1CDK2
SCHEMBL4549920 0.71 CDK2 (0.40) CDK4CCND1CCNE1CDK2

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 118 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-20140142306-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-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-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
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 CYP2D6 640/4885HRH3 3656/4885CDK4 12/4885
US-20230364098-A1 HSPC-SPARING TREATMENTS FOR RB-POSITIVE ABNORMAL CELLULAR PROLIFERATION RB1, CDK4, CDKN1A CYP2D6 3805/4885HRH3 1830/4885CDK4 2/4885
US-20230248733-A1 HIGHLY ACTIVE ANTI-NEOPLASTIC AND ANTI-PROLIFERATIVE AGENTS MKI67, PCNA, HRAS CYP2D6 4540/4885HRH3 1329/4885CDK4 16/4885
US-20230381189-A1 TRANSIENT PROTECTION OF NORMAL CELLS DURING CHEMOTHERAPY CDK6, CCNC, MCL1 CYP2D6 1687/4885HRH3 2229/4885CDK4 6/4885
US-20140142306-A1 CDK Inhibitors CDK3, CDK9, CDK6 CYP2D6 640/4885HRH3 3656/4885CDK4 12/4885
US-20230241059-A1 ANTI-NEOPLASTIC COMBINATIONS AND DOSING REGIMENS USING CDK4/6 INHIBITOR COMPOUNDS TO TREAT RB-POSITIVE TUMORS CDK4, RB1, BTK CYP2D6 2711/4885HRH3 2330/4885CDK4 1/4885
US-20140142299-A1 CDK Inhibitors CDK3, CDK9, CDK6 CYP2D6 640/4885HRH3 3656/4885CDK4 12/4885
US-11654148-B2 HSPC-sparing treatments for RB-positive abnormal cellular proliferation RB1, CDK4, CDKN1A CYP2D6 3805/4885HRH3 1830/4885CDK4 2/4885
US-11717523-B2 Transient protection of normal cells during chemotherapy CDK6, CCNC, MCL1 CYP2D6 1687/4885HRH3 2229/4885CDK4 6/4885
US-20130237544-A1 CDK INHIBITORS CDK3, CDK9, CDK6 CYP2D6 640/4885HRH3 3656/4885CDK4 12/4885

“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.