SCHEMBL7685381

SCHEMBL7685381

COC(=O)c1ccc(OC(F)(F)F)cc1N

nearest known ligand 0.65

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CFTR P13569 5/20 0.65
KDM4E B2RXH2 6/20 0.58
ALDH1A1 P00352 5/20 0.58
GAA P10253 5/20 0.58
HSD17B10 Q99714 3/20 0.58
MAPT P10636 3/20 0.58
GLA P06280 2/20 0.58
HPGD P15428 2/20 0.58
CASP1 P29466 1/20 0.58
CASP7 P55210 1/20 0.58
ATM Q13315 1/20 0.58
ABL1 P00519 2/20 0.57
ALOX15 P16050 1/20 0.44
TSHR P16473 1/20 0.44
MRGPRX4 Q96LA9 1/20 0.44
EPHX2 P34913 1/20 0.44
MAPK7 Q13164 1/20 0.43
PIM1 P11309 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL1438883 0.87 KDM4E (0.55) CFTRKDM4EALDH1A1GAAHSD17B10
SCHEMBL22749333 0.84 ALDH1A1 (0.58) CFTRKDM4EALDH1A1GAAHSD17B10
SCHEMBL22497443 0.83 ALDH1A1 (0.57) CFTRKDM4EALDH1A1GAAHSD17B10
SCHEMBL2314619 0.83 CHEK1 (0.47) CFTRKDM4EALDH1A1GAAHSD17B10
SCHEMBL30236136 0.83 CHEK1 (0.47) CFTRKDM4EALDH1A1GAAHSD17B10
SCHEMBL21339632 0.83 ALDH1A1 (0.54) CFTRKDM4EALDH1A1GAAHSD17B10
SCHEMBL858839 0.83 ALDH1A1 (0.66) CFTRKDM4EALDH1A1GAAHSD17B10
SCHEMBL24436789 0.82 CA12 (0.64) CFTRALDH1A1GAAHSD17B10HPGD
SCHEMBL20644248 0.82 CFTR (0.46) CFTRKDM4EALDH1A1ABL1MRGPRX4
SCHEMBL31168096 0.82 ABL1 (0.47) CFTRKDM4EALDH1A1GAAHSD17B10

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
CN-114728910-B Pyrazole derivative for FGFR inhibitor and preparation method thereof 上海奕拓医药科技有限责任公司 2024-05-14 CN disclosed
US-20220298143-A1 Pyrazole Derivatives for FGFR Inhibitor and Preparation Method Thereof ETERN BIOPHARMA (SHANGHAI) CO., LTD. (CN) 2022-09-22 US disclosed
CN-114728910-A Pyrazole derivatives for FGFR inhibitor and preparation method thereof 上海奕拓医药科技有限责任公司 2022-07-08 CN disclosed
EP-4023639-A1 PYRAZOLE DERIVATIVE FOR FGFR INHIBITOR AND PREPARATION METHOD THEREFOR Etern Biopharma (Shanghai) Co., Ltd. (CN) 2022-07-06 EP disclosed
EP-4023639-A1 PYRAZOLE DERIVATIVE FOR FGFR INHIBITOR AND PREPARATION METHOD THEREFOR Etern Biopharma (Shanghai) Co., Ltd. (CN) 2022-07-06 EP disclosed
CN-112441980-A Pyrazole derivatives for FGFR inhibitor and preparation method thereof 上海奕拓医药科技有限责任公司 2021-03-05 CN disclosed
WO-2021037219-A1 PYRAZOLE DERIVATIVE FOR FGFR INHIBITOR AND PREPARATION METHOD THEREFOR 上海奕拓医药科技有限责任公司 2021-03-04 WO disclosed
WO-2021037219-A1 PYRAZOLE DERIVATIVE FOR FGFR INHIBITOR AND PREPARATION METHOD THEREFOR 上海奕拓医药科技有限责任公司 2021-03-04 WO disclosed
US-20020045551-A1 4-benzoyl isoxazoles derivatives and their use as herbicides MUSIL TIBOR (GB) 2002-04-18 US disclosed
US-6323155-B1 EXCELLENT LEVEL OF HERBICIDAL ACTIVITY TOGETHER WITH CROP TOLERANCE RHONE-POULENC AGRICULTURE LIMITED (GB) 2001-11-27 US disclosed
EP-0674629-B1 4-BENZOYL ISOXAZOLES DERIVATIVES AND THEIR USE AS HERBICIDES RHONE POULENC AGRICULTURE (GB) 1998-07-08 EP disclosed
EP-0674629-A1 4-BENZOYL ISOXAZOLES DERIVATIVES AND THEIR USE AS HERBICIDES RHONE-POULENC AGRICULTURE LTD. (GB) 1995-10-04 EP disclosed
EP-0625505-A2 2-Cyano-1,3-dione derivatives and their use as herbicides RHONE POULENC AGRICULTURE LTD. (GB) 1994-11-23 EP disclosed
WO-1994014782-A1 4-BENZOYL ISOXAZOLES DERIVATIVES AND THEIR USE AS HERBICIDES RHONE-POULENC AGRICULTURE LTD. (GB) 1994-07-07 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 (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-20020045551-A1 4-benzoyl isoxazoles derivatives and their use as herbicides CBR3, CBR1, GLRA3 CFTR 517/4885KDM4E 2527/4885ALDH1A1 2037/4885
US-20220298143-A1 Pyrazole Derivatives for FGFR Inhibitor and Preparation Method Thereof FGFR1, FGFR2, FGFR3 CFTR 1221/4885KDM4E 1768/4885ALDH1A1 322/4885

“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.