SCHEMBL19836741

SCHEMBL19836741

CC(C)n1c(CF)nc2c(F)cc(Br)cc21

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ACACB O00763 1/20 0.35
▸ EGFR P00533 1/20 0.34
▸ CDK4 P11802 12/20 0.32
▸ CCND1 P24385 12/20 0.32
▸ CCND3 P30281 12/20 0.32
▸ CDK6 Q00534 12/20 0.32
▸ HTR2A P28223 3/20 0.31
▸ HTR2C P28335 3/20 0.31
▸ ALDH1A1 P00352 1/20 0.30
▸ PRPS1 P60891 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
SCHEMBL30039127 1.00 ACACB (0.35) ACACBEGFRCDK4CCND1CCND3
SCHEMBL19836743 0.87 CDK4 (0.38) ACACBCDK4CCND1CCND3CDK6
SCHEMBL29538572 0.87 CDK4 (0.38) ACACBCDK4CCND1CCND3CDK6
SCHEMBL22272297 0.85 NQO2 (0.33) —
SCHEMBL30040513 0.85 CDK4 (0.39) ACACBEGFRCDK4CCND1CCND3
SCHEMBL22644466 0.85 CDK4 (0.35) ACACBCDK4CCND1CCND3CDK6
SCHEMBL20987140 0.85 CDK4 (0.39) ACACBEGFRCDK4CCND1CCND3
SCHEMBL38662820 0.83 ACACB (0.37) ACACBCDK4CCND1CCND3CDK6
SCHEMBL21522779 0.82 CDK4 (0.43) ACACBCDK4CCND1CCND3CDK6
SCHEMBL30888981 0.82 CDK4 (0.43) ACACBCDK4CCND1CCND3CDK6

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
EP-3492462-B1 AMINO PYRIMIDINE COMPOUND FOR INHIBITING PROTEIN TYROSINE KINASE ACTIVITY SHENZHEN TARGETRX INC (CN) 2023-08-30 — — EP disclosed
EP-3492462-B1 AMINO PYRIMIDINE COMPOUND FOR INHIBITING PROTEIN TYROSINE KINASE ACTIVITY SHENZHEN TARGETRX INC (CN) 2023-08-30 — — EP disclosed
US-20230125233-A1 PYRIMIDINE DERIVATIVE, AND PREPARATION METHOD THEREFOR AND USE THEREOF CGENETECH (SUZHOU, CHINA) CO., LTD. (CN) 2023-04-27 — — US disclosed
US-20230125233-A1 PYRIMIDINE DERIVATIVE, AND PREPARATION METHOD THEREFOR AND USE THEREOF CGENETECH (SUZHOU, CHINA) CO., LTD. (CN) 2023-04-27 — — US disclosed
CN-113382991-B Aminopyrimidines useful for inhibiting protein tyrosine kinase activity 深圳市塔吉瑞生物医药有限公司 2022-12-27 — — CN disclosed
CN-113382991-A Aminopyrimidines useful for inhibiting protein tyrosine kinase activity 深圳市塔吉瑞生物医药有限公司 2021-09-10 — — CN disclosed
US-11111233-B2 Amino pyrimidine compound for inhibiting protein tyrosine kinase activity SHENZHEN TARGETRX, INC. (CN) 2021-09-07 — — US disclosed
CN-110818690-B Aminopyrimidines useful for inhibiting protein tyrosine kinase activity 深圳市塔吉瑞生物医药有限公司 2021-08-10 — — CN disclosed
CN-110818690-A Aminopyrimidines useful for inhibiting protein tyrosine kinase activity 深圳市塔吉瑞生物医药有限公司 2020-02-21 — — CN disclosed
CN-108602802-B Aminopyrimidines useful for inhibiting protein tyrosine kinase activity 深圳市塔吉瑞生物医药有限公司 2020-01-21 — — CN disclosed
EP-3492462-A1 AMINO PYRIMIDINE COMPOUND FOR INHIBITING PROTEIN TYROSINE KINASE ACTIVITY Shenzhen Targetrx, Inc. (CN) 2019-06-05 — — EP disclosed
EP-3492462-A1 AMINO PYRIMIDINE COMPOUND FOR INHIBITING PROTEIN TYROSINE KINASE ACTIVITY Shenzhen Targetrx, Inc. (CN) 2019-06-05 — — EP disclosed
US-20190152954-A1 AMINO PYRIMIDINE COMPOUND FOR INHIBITING PROTEIN TYROSINE KINASE ACTIVITY SHENZHEN TARGETRX, INC. (CN) 2019-05-23 — — US disclosed
WO-2018019204-A1 AMINO PYRIMIDINE COMPOUND FOR INHIBITING PROTEIN TYROSINE KINASE ACTIVITY 深圳市塔吉瑞生物医药有限公司 2018-02-01 — — 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 (3 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-20230125233-A1 PYRIMIDINE DERIVATIVE, AND PREPARATION METHOD THEREFOR AND USE THEREOF CDK8, WEE1, TYMP ACACB 4232/4885EGFR 3399/4885CDK4 9/4885
US-20190152954-A1 AMINO PYRIMIDINE COMPOUND FOR INHIBITING PROTEIN TYROSINE KINASE ACTIVITY LCK, WEE1, JAK1 ACACB 4805/4885EGFR 578/4885CDK4 83/4885
US-11111233-B2 Amino pyrimidine compound for inhibiting protein tyrosine kinase activity LCK, WEE1, JAK1 ACACB 4805/4885EGFR 578/4885CDK4 83/4885

“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.

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