SCHEMBL18558528

SCHEMBL18558528

CCCCCCC(CCCCCC)c1cc(C(F)F)[nH]n1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.32
▸ GPR84 Q9NQS5 1/20 0.31
▸ HCAR2 Q8TDS4 1/20 0.31
▸ NR1I2 O75469 1/20 0.31

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
SCHEMBL22692196 0.90 HCAR2 (0.34) GPR84HCAR2NR1I2
SCHEMBL22815352 0.79 CYP1A2 (0.39) GPR84HCAR2NR1I2
SCHEMBL19362661 0.79 CYP1A2 (0.39) GPR84HCAR2NR1I2
SCHEMBL22815348 0.79 CYP1A2 (0.39) GPR84HCAR2NR1I2
SCHEMBL19362615 0.77 HPGD (0.32) GPR84HCAR2NR1I2
SCHEMBL19362616 0.74 AURKA (0.33) GPR84HCAR2NR1I2
SCHEMBL24688350 0.72 HCAR2 (0.38) GPR84HCAR2
SCHEMBL24688161 0.68 CHEK1 (0.41) MAPTGPR84HCAR2
SCHEMBL21941436 0.67 NR1I2 (0.36) MAPTGPR84NR1I2
SCHEMBL23569869 0.67 NR1I2 (0.36) MAPTGPR84NR1I2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9932313-B2 Pyrazolyl guanidine F1F0-ATPase inhibitors and therapeutic uses thereof LYCERA CORPORATION (US) 2018-04-03 — — US disclosed
US-20170267643-A1 PYRAZOLYL GUANIDINE F1F0-ATPASE INHIBITORS AND THERAPEUTIC USES THEREOF WILMINGTON TRUST, NATIONAL ASSOCIATION 2017-09-21 — — US disclosed
US-9580388-B2 Pyrazolyl guanidine F1F0-ATPase inhibitors and therapeutic uses thereof LYCERA CORPORATION (US) 2017-02-28 — — 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 (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-20170267643-A1 PYRAZOLYL GUANIDINE F1F0-ATPASE INHIBITORS AND THERAPEUTIC USES THEREOF ATP5F1A, ATP5F1D, ATP5ME MAPT 3530/4885GPR84 2341/4885HCAR2 4338/4885

“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