SCHEMBL23199575

SCHEMBL23199575

N#Cc1cc(B(O)O)cc2c1OCC2

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
XDH P47989 1/20 0.34
SLC22A12 Q96S37 1/20 0.34
PARP1 P09874 1/20 0.33
ENPP2 Q13822 2/20 0.32

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
SCHEMBL31394723 0.75 PARP1 (0.36) PARP1
SCHEMBL20909185 0.75 PARP1 (0.36) PARP1
SCHEMBL8186519 0.75 XDH (0.34) XDHSLC22A12PARP1
SCHEMBL3188143 0.67 PARP1 (0.47) XDHSLC22A12PARP1
SCHEMBL943496 0.67 XDH (0.30) XDHSLC22A12
SCHEMBL4011401 0.67 PARP1 (0.46) PARP1
SCHEMBL4738465 0.66
SCHEMBL29915036 0.66 PARP1 (0.41) PARP1
SCHEMBL30749002 0.66 PARP1 (0.34) PARP1
SCHEMBL31344845 0.65 XDH (0.33) XDHSLC22A12PARP1

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
US-11046699-B2 Pyrazolo-pyrimidin-amino-cycloalkyl compounds and their therapeutic uses RAPT THERAPEUTICS, INC. (US) 2021-06-29 US disclosed
EP-3802544-A1 PYRAZOLO-PYRIMIDIN-AMINO-CYCLOALKYL COMPOUNDS AND THEIR THERAPEUTIC USES RAPT Therapeutics, Inc. (US) 2021-04-14 EP 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-11046699-B2 Pyrazolo-pyrimidin-amino-cycloalkyl compounds and their therapeutic uses GLS, GLS2, TK2 XDH 384/4885SLC22A12 3312/4885PARP1 182/4885

“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.