SCHEMBL23044892

SCHEMBL23044892

COC(=O)c1c(N)cc(N2CCN(CCC(F)(F)F)CC2)cc1F

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR4 Q13639 5/20 0.39
LMNA P02545 2/20 0.38
ALDH1A1 P00352 1/20 0.38
HTR7 P34969 1/20 0.38
MAPT P10636 2/20 0.38
DRD4 P21917 6/20 0.37
DRD2 P14416 4/20 0.36
NPC1 O15118 1/20 0.36
MEN1 O00255 1/20 0.36
HTT P42858 1/20 0.36
MAPK10 P53779 1/20 0.36
KMT2A Q03164 1/20 0.36
ADORA2B P29275 2/20 0.36
CHRM4 P08173 1/20 0.36
TSHR P16473 1/20 0.35
POLB P06746 1/20 0.35

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
SCHEMBL23044895 0.81 FGFR1 (0.39) LMNAMAPTDRD4MAPK10TSHR
SCHEMBL29214324 0.80 ALDH1A1 (0.38) HTR4LMNAALDH1A1HTR7MAPT
SCHEMBL23044993 0.80 ADRB1 (0.43) MAPTNPC1MEN1KMT2ACHRM4
SCHEMBL23044919 0.79 HTR4 (0.42) HTR4LMNAALDH1A1HTR7MAPT
SCHEMBL23044885 0.79 NPC1 (0.43) LMNAALDH1A1MAPTNPC1MEN1
SCHEMBL23044915 0.76 MAPT (0.45) LMNAALDH1A1MAPTMEN1HTT
SCHEMBL23044874 0.72 HTR4 (0.44) HTR4ALDH1A1MAPTMEN1KMT2A
SCHEMBL23044917 0.72 KDM4E (0.48) HTR4ALDH1A1HTR7MAPTDRD4
SCHEMBL23060231 0.68 CFTR (0.34) ALDH1A1MAPTTSHR
SCHEMBL19328837 0.68 MAPT (0.53) LMNAALDH1A1MAPTNPC1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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-20220298143-A1 Pyrazole Derivatives for FGFR Inhibitor and Preparation Method Thereof FGFR1, FGFR2, FGFR3 HTR4 4679/4885LMNA 4643/4885ALDH1A1 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.