SCHEMBL24635386

SCHEMBL24635386

O=[N+]([O-])c1ccc(OCc2ccccc2)c(C(F)(F)F)c1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIN1 Q13526 2/20 0.47
POLB P06746 1/20 0.44
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
MAPT P10636 2/20 0.43
CTSV O60911 3/20 0.43
CTSL P07711 3/20 0.43
TTR P02766 1/20 0.41
ALB P02768 1/20 0.41
THRB P10828 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
MAPK14 Q16539 1/20 0.41
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
SGMS2 Q8NHU3 1/20 0.40
HTR1A P08908 1/20 0.40
ADRA1D P25100 1/20 0.40
ADRA1A P35348 1/20 0.40
ADRA1B P35368 1/20 0.40
ATM Q13315 1/20 0.40

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
SCHEMBL31426422 0.83 PIN1 (0.50) PIN1POLBMEN1KMT2AMAPT
SCHEMBL16060171 0.80 PIN1 (0.50) PIN1POLBMEN1KMT2AMAPT
SCHEMBL31234027 0.78 PIN1 (0.53) PIN1POLBMEN1KMT2AMAPT
SCHEMBL1937604 0.78 PIN1 (0.53) PIN1POLBMEN1KMT2AMAPT
SCHEMBL8546360 0.77 PIN1 (0.50) PIN1POLBMEN1KMT2AMAPT
SCHEMBL3922556 0.76 RXRA (0.52) POLBMEN1KMT2AMAPTCTSV
SCHEMBL573839 0.75 CTSV (0.49) PIN1POLBMEN1KMT2AMAPT
SCHEMBL29447092 0.74 MAPT (0.59) POLBMEN1KMT2AMAPTCTSV
SCHEMBL4879420 0.74 POLB (0.57) PIN1POLBMEN1KMT2AMAPT
SCHEMBL564270 0.74 MAPT (0.59) POLBMEN1KMT2AMAPTCTSV

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4083038-A1 PYRIDAZINYL THIAZOLECARBOXAMIDE COMPOUND Astellas Pharma Inc. (JP) 2022-11-02 EP disclosed
US-20220315603-A1 PYRIDAZINYL-THIAZOLECARBOXAMIDE COMPOUND KOTOBUKI PHARMACEUTICAL CO., LTD. (JP) 2022-10-06 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-20220315603-A1 PYRIDAZINYL-THIAZOLECARBOXAMIDE COMPOUND CD274, PDCD1, PDCD1LG2 PIN1 1664/4885POLB 1637/4885MEN1 4078/4885

“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.