SCHEMBL14342571

SCHEMBL14342571

C(=C/c1cc(/C=C/c2ccccc2)[nH]n1)\c1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 4/20 0.68
▸ KDM4E B2RXH2 7/20 0.58
▸ HPGD P15428 4/20 0.58
▸ LMNA P02545 2/20 0.58
▸ CYP1A2 P05177 1/20 0.58
▸ KMT2A Q03164 4/20 0.52
▸ MEN1 O00255 3/20 0.52
▸ ALDH1A1 P00352 5/20 0.52
▸ RAB9A P51151 4/20 0.51
▸ NPC1 O15118 3/20 0.51
▸ POLB P06746 3/20 0.51
▸ MAPT P10636 3/20 0.50
▸ NFKB1 P19838 2/20 0.50
▸ APP P05067 1/20 0.50
▸ ALOX5 P09917 1/20 0.50
▸ MMP9 P14780 1/20 0.50
▸ ALOX12 P18054 1/20 0.50
▸ KDR P35968 1/20 0.50
▸ STAT3 P40763 1/20 0.50
▸ NFKB2 Q00653 1/20 0.50

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
SCHEMBL1793300 0.90 PTGS2 (0.87) PTGS2KDM4EHPGDLMNACYP1A2
SCHEMBL1793302 0.90 PTGS2 (0.87) PTGS2KDM4EHPGDLMNACYP1A2
SCHEMBL1793303 0.90 PTGS2 (0.87) PTGS2KDM4EHPGDLMNACYP1A2
SCHEMBL14342572 0.90 PTGS2 (0.87) PTGS2KDM4EHPGDLMNACYP1A2
SCHEMBL17068289 0.89 PTGS2 (0.56) PTGS2KDM4EHPGDLMNACYP1A2
SCHEMBL27766349 0.81 KDM4E (0.54) PTGS2KDM4EHPGDLMNACYP1A2
SCHEMBL1790052 0.79 APP (0.88) PTGS2MAPTNFKB1APPALOX5
SCHEMBL1790054 0.79 APP (0.88) PTGS2MAPTNFKB1APPALOX5
SCHEMBL27773488 0.78 POLB (0.50) PTGS2KDM4EHPGDLMNACYP1A2
SCHEMBL29799041 0.78 PTGS2 (0.65) PTGS2KDM4ELMNAKMT2AMEN1

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
WO-2022186362-A1 METHOD FOR PRODUCING PYRAZOLE COMPOUND 白鳥製薬株式会社 2022-09-09 — — WO disclosed
US-8710038-B2 Pyrazole kinase modulators and methods of use EXELIXIS, INC. (US) 2014-04-29 — — US disclosed
US-20070293507-A1 Pyrazole Kinase Modulators And Methods Of Use EXELIXIS, INC. (US) 2007-12-20 — — 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-20070293507-A1 Pyrazole Kinase Modulators And Methods Of Use MAP3K1, MAP3K3, MAP3K5 PTGS2 768/4885KDM4E 1090/4885HPGD 1237/4885

“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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