SCHEMBL18562032

SCHEMBL18562032

COc1cc(-c2cccc3nc(-c4n[nH]c5ccccc45)[nH]c23)cc(OC)c1OC

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK2 P24941 10/20 0.56
▸ CDK4 P11802 8/20 0.56
▸ CCNA2 P20248 8/20 0.56
▸ CCND1 P24385 8/20 0.56
▸ CCND3 P30281 8/20 0.56
▸ FGFR1 P11362 3/20 0.51
▸ FLT1 P17948 2/20 0.51
▸ BRD4 O60885 2/20 0.51
▸ KDR P35968 4/20 0.51
▸ CHEK1 O14757 4/20 0.51
▸ JAK2 O60674 3/20 0.51
▸ TYK2 P29597 3/20 0.51
▸ JAK3 P52333 3/20 0.51
▸ JAK1 P23458 2/20 0.51
▸ ITK Q08881 3/20 0.50
▸ PDPK1 O15530 2/20 0.45
▸ PLK4 O00444 1/20 0.45
▸ AURKA O14965 1/20 0.45
▸ CHUK O15111 1/20 0.45
▸ ROCK2 O75116 1/20 0.45

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
SCHEMBL17251722 0.85 CDK2 (0.53) CDK2CDK4CCNA2CCND1CCND3
SCHEMBL17251750 0.81 MAPT (0.50) BRD4JAK2TYK2JAK1FYN
SCHEMBL30222327 0.81 FGFR1 (0.68) CDK2CDK4CCNA2CCND1CCND3
SCHEMBL17251702 0.78 BRD4 (0.38) CDK2CDK4CCNA2CCND1CCND3
SCHEMBL18562045 0.77 CDK2 (0.53) CDK2CDK4CCNA2CCND1CCND3
SCHEMBL18576291 0.75 CDK2 (0.48) CDK2CDK4CCNA2CCND1CCND3
SCHEMBL5952843 0.75 CDK2 (0.64) CDK2CDK4CCNA2CCND1CCND3
SCHEMBL5952685 0.75 FGFR1 (0.63) CDK2CDK4CCNA2CCND1CCND3
SCHEMBL5508107 0.72 CDK4 (0.60) CDK2CDK4CCNA2CCND1CCND3
SCHEMBL5952268 0.72 FGFR1 (0.67) CDK2CDK4CCNA2CCND1CCND3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3708164-A1 COMPOUNDS FOR TREATMENT OF CANCER Oncternal Therapeutics, Inc (US) 2020-09-16 — — EP disclosed
EP-3139919-B1 COMPOUNDS FOR TREATMENT OF CANCER ONCTERNAL THERAPEUTICS INC (US) 2020-06-03 — — EP disclosed
US-9981915-B2 Compounds for treatment of cancer UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2018-05-29 — — US disclosed
US-9981915-B2 Compounds for treatment of cancer UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2018-05-29 — — US disclosed
US-20180118693-A1 COMPOUNDS FOR TREATMENT OF CANCER GTX, INC. (US) 2018-05-03 — — US disclosed
US-20180118693-A1 COMPOUNDS FOR TREATMENT OF CANCER GTX, INC. (US) 2018-05-03 — — US disclosed
US-20170057930-A1 COMPOUNDS FOR TREATMENT OF CANCER GTX, INC. (US) 2017-03-02 — — US disclosed
US-20170057930-A1 COMPOUNDS FOR TREATMENT OF CANCER GTX, INC. (US) 2017-03-02 — — 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 (2 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-20180118693-A1 COMPOUNDS FOR TREATMENT OF CANCER TP53, TUBB1, TUBB6 CDK2 298/4885CDK4 197/4885CCNA2 700/4885
US-20170057930-A1 COMPOUNDS FOR TREATMENT OF CANCER TP53, TUBB1, TUBB6 CDK2 298/4885CDK4 197/4885CCNA2 700/4885

“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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