SCHEMBL20711666

SCHEMBL20711666

CC(C)c1ccc(O)c(Cl)c1F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.41
▸ ADRA1A P35348 3/20 0.41
▸ SLC6A2 P23975 2/20 0.41
▸ HTR2B P41595 2/20 0.41
▸ TRPA1 O75762 1/20 0.41
▸ CHRM1 P11229 1/20 0.41
▸ GABRA1 P14867 3/20 0.40
▸ GABRB2 P47870 2/20 0.40
▸ GABRB1 P18505 2/20 0.39
▸ CYP3A4 P08684 2/20 0.38
▸ MAPK1 P28482 2/20 0.38
▸ ADRB2 P07550 2/20 0.38
▸ ADRB1 P08588 1/20 0.38
▸ ADRB3 P13945 1/20 0.38
▸ FAAH O00519 1/20 0.37
▸ CA1 P00915 1/20 0.37
▸ CA2 P00918 1/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ TSHR P16473 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
SCHEMBL23432951 0.82 EIF4A3 (0.36) LMNAADRA1ASLC6A2HTR2BTRPA1
SCHEMBL20443883 0.80 ADRA1A (0.45) LMNAADRA1ASLC6A2HTR2BTRPA1
SCHEMBL12599943 0.78 GABRA1 (0.37) LMNAADRA1ASLC6A2HTR2BTRPA1
SCHEMBL21567158 0.78 CYP3A4 (0.38) LMNAADRA1ASLC6A2HTR2BTRPA1
SCHEMBL15631302 0.78 ADRA1A (0.57) LMNAADRA1ASLC6A2HTR2BTRPA1
SCHEMBL17517184 0.77 LMNA (0.35) LMNAADRA1ASLC6A2HTR2BTRPA1
SCHEMBL15553081 0.77 LMNA (0.47) LMNAADRA1ASLC6A2HTR2BTRPA1
SCHEMBL27956120 0.77 ADRA1A (0.42) LMNAADRA1ASLC6A2HTR2BTRPA1
SCHEMBL22483860 0.75 EIF4A3 (0.33) GABRA1GABRB1EIF4A3
SCHEMBL19249192 0.74 GABRA1 (0.50) LMNAADRA1ASLC6A2HTR2BTRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10968205-B2 Pyrazolo and triazolo bicyclic compounds as JAK kinase inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2021-04-06 — — US disclosed
US-20200216423-A1 PYRAZOLO AND TRIAZOLO BICYCLIC COMPOUNDS AS JAK KINASE INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2020-07-09 — — US disclosed
US-10538513-B2 Pyrazolo and triazolo bicyclic compounds as JAK kinase inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2020-01-21 — — US disclosed
US-20190315724-A1 PYRAZOLO AND TRIAZOLO BICYCLIC COMPOUNDS AS JAK KINASE INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2019-10-17 — — US disclosed
US-10392368-B2 Pyrazolo and triazolo bicyclic compounds as JAK kinase inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2019-08-27 — — US disclosed
WO-2019027960-A1 PYRAZOLO AND TRIAZOLO BICYCLIC COMPOUNDS AS JAK KINASE INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2019-02-07 — — WO disclosed
US-20190040043-A1 PYRAZOLO AND TRIAZOLO BICYCLIC COMPOUNDS AS JAK KINASE INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2019-02-07 — — 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 (6 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-20190315724-A1 PYRAZOLO AND TRIAZOLO BICYCLIC COMPOUNDS AS JAK KINASE INHIBITORS JAK3, JAK1, JAK2 LMNA 4634/4885ADRA1A 4333/4885SLC6A2 4614/4885
US-10968205-B2 Pyrazolo and triazolo bicyclic compounds as JAK kinase inhibitors JAK3, JAK1, JAK2 LMNA 4634/4885ADRA1A 4333/4885SLC6A2 4614/4885
US-20190040043-A1 PYRAZOLO AND TRIAZOLO BICYCLIC COMPOUNDS AS JAK KINASE INHIBITORS JAK3, JAK1, JAK2 LMNA 4634/4885ADRA1A 4333/4885SLC6A2 4614/4885
US-10392368-B2 Pyrazolo and triazolo bicyclic compounds as JAK kinase inhibitors JAK3, JAK1, JAK2 LMNA 4634/4885ADRA1A 4333/4885SLC6A2 4614/4885
US-20200216423-A1 PYRAZOLO AND TRIAZOLO BICYCLIC COMPOUNDS AS JAK KINASE INHIBITORS JAK3, JAK1, JAK2 LMNA 4634/4885ADRA1A 4333/4885SLC6A2 4614/4885
US-10538513-B2 Pyrazolo and triazolo bicyclic compounds as JAK kinase inhibitors JAK3, JAK1, JAK2 LMNA 4634/4885ADRA1A 4333/4885SLC6A2 4614/4885

“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