SCHEMBL15340730

SCHEMBL15340730

CONC1c2ccccc2CCCC1F

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.44
GID4 Q8IVV7 1/20 0.42
KMT2A Q03164 3/20 0.40
MEN1 O00255 1/20 0.40
TAS1R3 Q7RTX0 1/20 0.40
TAS1R1 Q7RTX1 1/20 0.40
TAS1R2 Q8TE23 1/20 0.40
PDPK1 O15530 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
USP2 O75604 1/20 0.39
MAOB P27338 2/20 0.38
MAOA P21397 1/20 0.38

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
SCHEMBL4756410 0.73 IDO1 (0.50) IDO1KMT2AMEN1PDPK1ALDH1A1
SCHEMBL18995777 0.72 PDPK1 (0.58) IDO1TAS1R3TAS1R1TAS1R2PDPK1
SCHEMBL30056716 0.69 IDO1 (0.53) IDO1KMT2AMEN1PDPK1ALDH1A1
SCHEMBL4248158 0.69 IDO1 (0.53) IDO1KMT2AMEN1PDPK1ALDH1A1
SCHEMBL29518873 0.68 IDO1 (0.68) IDO1GID4KMT2AMEN1PDPK1
SCHEMBL3907558 0.68 IDO1 (0.68) IDO1GID4KMT2AMEN1PDPK1
SCHEMBL12727345 0.68 IDO1 (0.68) IDO1GID4KMT2AMEN1PDPK1
SCHEMBL31251494 0.68 IDO1 (0.68) IDO1GID4KMT2AMEN1PDPK1
SCHEMBL2472307 0.68 IDO1 (0.68) IDO1GID4KMT2AMEN1PDPK1
Hydrochloric Acid SCHEMBL10524447 0.66 IDO1 (0.45) IDO1KMT2AMEN1TAS1R3TAS1R1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8653003-B2 Pyrazol-4-yl carboxamide derivatives as microbiocides SYNGENTA PARTICIPATIONS AG (CH) 2014-02-18 US disclosed
US-8653003-B2 Pyrazol-4-yl carboxamide derivatives as microbiocides SYNGENTA PARTICIPATIONS AG (CH) 2014-02-18 US disclosed
US-20130281505-A1 PYRAZOL-4-YL CARBOXAMIDE DERIVATIVES AS MICROBIOCIDES SYNGENTA PARTICIPATIONS AG (CH) 2013-10-24 US disclosed
US-20130281505-A1 PYRAZOL-4-YL CARBOXAMIDE DERIVATIVES AS MICROBIOCIDES SYNGENTA PARTICIPATIONS AG (CH) 2013-10-24 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-20130281505-A1 PYRAZOL-4-YL CARBOXAMIDE DERIVATIVES AS MICROBIOCIDES C3AR1, CD209, CCR9 IDO1 139/4885GID4 3777/4885KMT2A 4246/4885

“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.