SCHEMBL4207481

SCHEMBL4207481

OC1CNc2ccccc2C1O

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PARP3 Q9Y6F1 1/20 0.40
CHRNB4 P30926 1/20 0.34
CHRNA3 P32297 1/20 0.34
PAX8 Q06710 1/20 0.33
GBA1 P04062 1/20 0.33
IDO1 P14902 1/20 0.33
KCNH2 Q12809 1/20 0.33
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
KMT2A Q03164 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CCKBR P32239 2/20 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
SCHEMBL793625 0.78 CHRNB4 (0.37) PARP3CHRNB4CHRNA3PAX8KCNH2
SCHEMBL29636531 0.78 CHRNB4 (0.37) PARP3CHRNB4CHRNA3PAX8KCNH2
SCHEMBL8703745 0.78 CHRNB4 (0.37) PARP3CHRNB4CHRNA3PAX8KCNH2
SCHEMBL17749125 0.74 PAX8 (0.32) PARP3PAX8GBA1
SCHEMBL19277393 0.74 PAX8 (0.32) PARP3PAX8GBA1
SCHEMBL30417082 0.73 CHRNB4 (0.39) PARP3CHRNB4CHRNA3PAX8MEN1
SCHEMBL4198061 0.72 HTR1A (0.37) PARP3PAX8MEN1KMT2AALDH1A1
SCHEMBL4198060 0.72 HTR1A (0.37) PARP3PAX8MEN1KMT2AALDH1A1
SCHEMBL4198062 0.72 HTR1A (0.37) PARP3PAX8MEN1KMT2AALDH1A1
SCHEMBL5507570 0.72 HTR1A (0.37) PARP3PAX8MEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0142241-B1 DIHYDROXYBENZAMIDE DERIVATIVES HAVING ANTI-INFLAMMATORY ACTIVITY KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1987-12-02 EP claimed
EP-0142241-A1 Dihydroxybenzamide derivatives having anti-inflammatory activity KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1985-05-22 EP claimed
WO-2009103007-A2 STEROID HORMONE RECEPTOR MODULATOR COMPOUNDS AND METHODS LIGAND PHARMACEUTICALS INCORPORATED (US) 2009-08-20 WO disclosed
US-20070254917-A1 INTRACELLULAR RECEPTOR MODULATOR COMPOUNDS AND METHODS LIGAND PHARMACEUTICALS INC. 2007-11-01 US disclosed
CN-101018552-A Intracellular receptor modulator compounds and methods LIGAND PHARM INC (US) 2007-08-15 CN disclosed
EP-1778233-A1 INTRACELLULAR RECEPTOR MODULATOR COMPOUNDS AND METHODS LIGAND PHARMACEUTICALS, INC. (US) 2007-05-02 EP disclosed
WO-2006019716-A1 INTRACELLULAR RECEPTOR MODULATOR COMPOUNDS AND METHODS LIGAND PHARMACEUTICALS, INC. (US) 2006-02-23 WO 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-20070254917-A1 INTRACELLULAR RECEPTOR MODULATOR COMPOUNDS AND METHODS CASR, GRK2, RYR2 PARP3 2654/4885CHRNB4 378/4885CHRNA3 345/4885

“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.