SCHEMBL19948657

SCHEMBL19948657

O=C(O)NC1CCCc2c(F)cc(F)cc21

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CYP11B1 P15538 7/20 0.43
▸ CYP11B2 P19099 7/20 0.43
▸ BRD3 Q15059 1/20 0.41
▸ TAS1R3 Q7RTX0 3/20 0.40
▸ TAS1R1 Q7RTX1 3/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ HCAR2 Q8TDS4 2/20 0.40
▸ TAS1R2 Q8TE23 2/20 0.40
▸ KMT2A Q03164 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ DHODH Q02127 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ NR1I2 O75469 1/20 0.37
▸ TRPM8 Q7Z2W7 1/20 0.37

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
SCHEMBL19961240 0.80 CYP11B1 (0.41) CYP11B1CYP11B2BRD3
SCHEMBL784503 0.77 CYP11B2 (0.36) CYP11B1CYP11B2TAS1R3TAS1R1NPSR1
SCHEMBL19948974 0.74 TAS1R3 (0.42) CYP11B1CYP11B2TAS1R3TAS1R1NPSR1
SCHEMBL24593689 0.73 UGT2B17 (0.51) CYP11B1CYP11B2BRD3HCAR2KMT2A
SCHEMBL6958845 0.73 UGT2B17 (0.51) CYP11B1CYP11B2BRD3HCAR2KMT2A
SCHEMBL24543311 0.72 SIRT1 (0.36) CYP11B1CYP11B2BRD3HCAR2NR1I2
SCHEMBL19948793 0.71 NR1I2 (0.42) CYP11B1CYP11B2BRD3HCAR2KMT2A
Acetic Acid SCHEMBL28780395 0.71 GAA (0.40) HCAR2NR1I2TRPM8
SCHEMBL23362943 0.71 TAS1R3 (0.46) TAS1R3TAS1R1NPSR1TAS1R2KMT2A
SCHEMBL23363142 0.71 TAS1R3 (0.49) TAS1R3TAS1R1NPSR1TAS1R2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11542265-B2 Pyrazolopyrimidine compounds and uses thereof INCYTE CORPORATION (US) 2023-01-03 — — US disclosed
US-20210371425-A1 PYRAZOLOPYRIMIDINE COMPOUNDS AND USES THEREOF INCYTE CORPORATION 2021-12-02 — — US disclosed
US-11014929-B2 Pyrazolopyrimidine compounds and uses thereof INCYTE CORPORATION (US) 2021-05-25 — — US disclosed
US-20200172545-A1 PYRAZOLOPYRIMIDINE COMPOUNDS AND USES THEREOF INCYTE CORPORATION 2020-06-04 — — US disclosed
WO-2018049152-A1 PYRAZOLOPYRIMIDINE DERIVATIVES AS HPK1 MODULATORS AND USES THEREOF FOR THE TREATMENT OF CANCER INCYTE CORPORATION (US) 2018-03-15 — — WO disclosed
US-20180072741-A1 PYRAZOLOPYRIMIDINE COMPOUNDS AND USES THEREOF INCYTE CORPORATION 2018-03-15 — — 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 (5 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-20200172545-A1 PYRAZOLOPYRIMIDINE COMPOUNDS AND USES THEREOF PDXK, PCK1, MAPKAPK5 CYP11B1 780/4885CYP11B2 779/4885BRD3 2479/4885
US-20180072741-A1 PYRAZOLOPYRIMIDINE COMPOUNDS AND USES THEREOF PDXK, PCK1, PDK2 CYP11B1 822/4885CYP11B2 793/4885BRD3 2853/4885
US-11014929-B2 Pyrazolopyrimidine compounds and uses thereof PDXK, PCK1, MAPKAPK5 CYP11B1 780/4885CYP11B2 779/4885BRD3 2479/4885
US-11542265-B2 Pyrazolopyrimidine compounds and uses thereof PDXK, PCK1, PDK2 CYP11B1 822/4885CYP11B2 793/4885BRD3 2853/4885
US-20210371425-A1 PYRAZOLOPYRIMIDINE COMPOUNDS AND USES THEREOF PDXK, PCK1, PDK2 CYP11B1 822/4885CYP11B2 793/4885BRD3 2853/4885

“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.

Send feedback