SCHEMBL20214101

SCHEMBL20214101

COC(=O)c1cc(O)nn1-c1nc(-c2ccc(C(F)(F)F)cc2)c(SC(C)C)s1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2RL3 Q96RI0 1/20 0.35
KDM4E B2RXH2 4/20 0.34
MAPT P10636 3/20 0.34
MYC P01106 2/20 0.34
WDR5 P61964 2/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
HSP90AA1 P07900 1/20 0.34
CRHBP P24387 1/20 0.34
CRHR2 Q13324 1/20 0.34
BTK Q06187 1/20 0.33
ALDH1A1 P00352 3/20 0.33
NPSR1 Q6W5P4 1/20 0.33
GAA P10253 1/20 0.33
ALOX15 P16050 1/20 0.33
HSD17B10 Q99714 1/20 0.33
PPARD Q03181 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PTGER1 P34995 1/20 0.33
NTRK1 P04629 1/20 0.33

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
SCHEMBL20214102 0.90 DYRK3 (0.35) F2RL3KDM4EMAPTMYCWDR5
SCHEMBL29231587 0.90 PTGER1 (0.38) F2RL3KDM4EMAPTMYCWDR5
SCHEMBL30829470 0.85 MYC (0.35) F2RL3KDM4EMAPTMYCWDR5
SCHEMBL28343892 0.83 MYC (0.37) F2RL3KDM4EMAPTMYCWDR5
SCHEMBL20214050 0.82 KDM4E (0.35) F2RL3KDM4EMAPTMYCWDR5
SCHEMBL28347074 0.82 AKR1C3 (0.36) F2RL3KDM4EMYCWDR5MEN1
SCHEMBL18282149 0.81 ALDH1A1 (0.34) F2RL3KDM4EMAPTMYCWDR5
SCHEMBL20214527 0.80 F2RL3 (0.33) F2RL3KDM4EMAPTMYCWDR5
SCHEMBL18282157 0.79 NPC1 (0.35) KDM4EMAPTMYCWDR5MEN1
SCHEMBL20214041 0.79 PDE2A (0.34) KDM4EMAPTMEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118930533-A Substituted pyrazole compounds and methods of using the same for treating hyperproliferative diseases 班塔姆制药有限责任公司 2024-11-12 CN disclosed
CN-110603254-B Substituted pyrazole compounds and methods of using the same for treating hyperproliferative diseases 班塔姆制药有限责任公司 2024-04-12 CN disclosed
US-20230076820-A1 Substituted Pyrazole Compounds and Methods of Using Them for Treatment of Hyperproliferative Diseases BANTAM PHARMACEUTICAL, LLC 2023-03-09 US disclosed
US-11325903-B2 Substituted pyrazole compounds and methods of using them for treatment of hyperproliferative diseases BANTAM PHARMACEUTICAL, LLC (US) 2022-05-10 US disclosed
US-11192887-B2 2021-12-07 US disclosed
CN-110603254-A Substituted pyrazole compounds and methods of using the same for treating hyperproliferative diseases 班塔姆制药有限责任公司 2019-12-20 CN disclosed
US-20190345152-A1 Substituted Pyrazole Compounds and Methods of Using Them for Treatment of Hyperproliferative Diseases BANTAM PHARMACEUTICAL, LLC 2019-11-14 US disclosed
EP-3548482-A1 SUBSTITUTED PYRAZOLE COMPOUNDS AND METHODS OF USING THEM FOR TREATMENT OF HYPERPROLIFERATIVE DISEASES Bantam Pharmaceutical, LLC (US) 2019-10-09 EP disclosed
WO-2018102453-A1 SUBSTITUTED PYRAZOLE COMPOUNDS AND METHODS OF USING THEM FOR TREATMENT OF HYPERPROLIFERATIVE DISEASES BANTAM PHARMACEUTICAL, LLC (US) 2018-06-07 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 (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-11325903-B2 Substituted pyrazole compounds and methods of using them for treatment of hyperproliferative diseases KRAS, TP53, CCNI F2RL3 2726/4885KDM4E 3557/4885MAPT 4854/4885
US-20190345152-A1 Substituted Pyrazole Compounds and Methods of Using Them for Treatment of Hyperproliferative Diseases KRAS, TP53, CCNI F2RL3 2726/4885KDM4E 3557/4885MAPT 4854/4885
US-11192887-B2 KRAS, TP53, CCNE1 F2RL3 3257/4885KDM4E 3282/4885MAPT 4876/4885
US-20230076820-A1 Substituted Pyrazole Compounds and Methods of Using Them for Treatment of Hyperproliferative Diseases KRAS, TP53, NRAS F2RL3 2036/4885KDM4E 3227/4885MAPT 4855/4885

“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.