SCHEMBL14729667

SCHEMBL14729667

FC(F)(F)c1ccc(-c2cc(OCc3ccccc3)c(OCc3ccccc3)nn2)c(Cl)c1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 18/20 0.48
RXRA P19793 1/20 0.47
RXRB P28702 1/20 0.47
RXRG P48443 1/20 0.47
HTR2C P28335 1/20 0.43
SLC6A4 P31645 1/20 0.43
HTR2B P41595 1/20 0.43

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
SCHEMBL14729682 0.87 RXRA (0.47) MRGPRX4RXRARXRBRXRGHTR2C
SCHEMBL14729662 0.82 BRD4 (0.43) RXRARXRBSLC6A4
SCHEMBL14729703 0.80 MRGPRX4 (0.43) MRGPRX4RXRARXRBRXRGHTR2C
SCHEMBL14729714 0.80 PTPN1 (0.50) MRGPRX4RXRARXRBRXRGHTR2C
SCHEMBL14719052 0.79 MRGPRX4 (0.44) MRGPRX4
SCHEMBL14729718 0.79 CYP2C19 (0.46) MRGPRX4RXRARXRBRXRG
SCHEMBL30427926 0.78 MRGPRX4 (0.72) MRGPRX4
SCHEMBL14729679 0.75 CYP11B1 (0.44) MRGPRX4RXRARXRBRXRGHTR2C
SCHEMBL14729678 0.75 PTGER1 (0.46) MRGPRX4SLC6A4
SCHEMBL14718544 0.75 HTR2C (0.48) MRGPRX4RXRARXRBRXRGHTR2C

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
EP-2748149-B1 PYRIDAZINONE COMPOUNDS AND THEIR USE AS DAAO INHIBITORS TAKEDA PHARMACEUTICAL (JP) 2015-10-21 EP disclosed
WO-2013027000-A1 PYRIDAZINONE COMPOUNDS AND THEIR USE AS DAAO INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-02-28 WO disclosed
US-20130052281-A1 NOVEL COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-02-28 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-20130052281-A1 NOVEL COMPOUNDS ABCG2, F12, UGT1A1 MRGPRX4 97/4885RXRA 438/4885RXRB 388/4885

“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.