SCHEMBL25745865

SCHEMBL25745865

CCc1c(OC)cc(C(C)(C)C)cc1C(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HTR2A P28223 5/20 0.37
▸ HTR2C P28335 1/20 0.37
▸ CRHR1 P34998 3/20 0.35
▸ LMNA P02545 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ PTGS2 P35354 1/20 0.32
▸ PDE3B Q13370 1/20 0.30
▸ PDE3A Q14432 1/20 0.30
▸ LRRK2 Q5S007 1/20 0.30

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
SCHEMBL26011545 0.85 CACNA1H (0.38) HTR2AHTR2CCRHR1LMNATP53
SCHEMBL25745801 0.79 ACHE (0.41) HTR2AHTR2CCRHR1HPGDPTGS2
SCHEMBL19803230 0.79 HTR1D (0.35) HTR2AHTR2CLMNATP53CYP3A4
SCHEMBL16009749 0.79 HTR2A (0.39) HTR2AHTR2CCRHR1
SCHEMBL22017132 0.79 HTR2A (0.39) HTR2AHTR2CCRHR1PTGS2PDE3B
SCHEMBL19871663 0.78 HTR2A (0.38) HTR2AHTR2CLMNAPTGS2
SCHEMBL21766572 0.72 CACNA1H (0.37) CYP3A4
SCHEMBL13073510 0.72 HTR2A (0.43) HTR2AHTR2CLMNATP53CYP3A4
SCHEMBL12012739 0.72 HTR2A (0.41) HTR2AHTR2CHPGDALOX15
SCHEMBL26012392 0.71 CACNA1H (0.35) HTR2AHTR2CCRHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230265075-A1 6-HETEROARYLOXY BENZIMIDAZOLES AND AZABENZIMIDAZOLES AS JAK2 INHIBITORS AJAX THERAPEUTICS, INC. 2023-08-24 — — US disclosed
US-11691963-B2 6-heteroaryloxy benzimidazoles and azabenzimidazoles as JAK2 inhibitors AJAX THERAPEUTICS, INC. (US) 2023-07-04 — — 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 (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-20230265075-A1 6-HETEROARYLOXY BENZIMIDAZOLES AND AZABENZIMIDAZOLES AS JAK2 INHIBITORS JAK2, JAK3, STAT5B HTR2A 1660/4885HTR2C 1031/4885CRHR1 3851/4885
US-11691963-B2 6-heteroaryloxy benzimidazoles and azabenzimidazoles as JAK2 inhibitors JAK2, JAK3, STAT5B HTR2A 1660/4885HTR2C 1031/4885CRHR1 3851/4885

“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.

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