SCHEMBL29525440

SCHEMBL29525440

Cc1cc(-c2cnc3cn[nH]c3c2)ccc1F

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 2/20 0.52
GRIN2B Q13224 17/20 0.47
GRIN1 Q05586 5/20 0.46
FGFR1 P11362 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
KCNH2 Q12809 1/20 0.44

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
SCHEMBL22771445 1.00 TGFBR1 (0.52) TGFBR1GRIN2BGRIN1FGFR1CYP1A2
SCHEMBL30133030 0.86 PDGFRB (0.48) TGFBR1GRIN2BGRIN1FGFR1
SCHEMBL30117390 0.83 TGFBR1 (0.51) TGFBR1GRIN2BGRIN1CYP1A2CYP2C9
SCHEMBL15639521 0.83 TGFBR1 (0.51) TGFBR1GRIN2BGRIN1CYP1A2CYP2C9
SCHEMBL30133051 0.82 RAF1 (0.47) GRIN2BGRIN1FGFR1
SCHEMBL22771417 0.81 GRIN2B (0.51) GRIN2BGRIN1KCNH2
SCHEMBL22771356 0.81 GRIN2B (0.51) GRIN2BGRIN1KCNH2
SCHEMBL29901554 0.80 GRIN2B (0.52) GRIN2BGRIN1
SCHEMBL29525098 0.80 DYRK1A (0.49) TGFBR1GRIN2BGRIN1FGFR1
SCHEMBL17754852 0.80 DYRK1A (0.49) TGFBR1GRIN2BGRIN1FGFR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11530210-B2 Substituted heteroaromatic pyrazolo-pyridines and their use as GLUN2B receptor modulators JANSSEN PHARMACEUTICA NV (BE) 2022-12-20 US disclosed
US-20220324860-A1 SUBSTITUTED PYRAZOLO[4,3-b]PYRIDINES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2022-10-13 US disclosed
EP-3983075-A1 SUBSTITUTED PYRAZOLO-PYRIDINE AMIDES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS Janssen Pharmaceutica NV (BE) 2022-04-20 EP disclosed
EP-3982958-A1 SUBSTITUTED HETEROAROMATIC PYRAZOLO-PYRIDINES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS Janssen Pharmaceutica NV (BE) 2022-04-20 EP disclosed
EP-3983073-A1 SUBSTITUTED PYRAZOLO[4,3-B]PYRIDINES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS Janssen Pharmaceutica NV (BE) 2022-04-20 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 (2 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-20220324860-A1 SUBSTITUTED PYRAZOLO[4,3-b]PYRIDINES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS GRIN2B, GRIN3B, GRIN3A TGFBR1 1233/4885GRIN2B 1/4885GRIN1 7/4885
US-11530210-B2 Substituted heteroaromatic pyrazolo-pyridines and their use as GLUN2B receptor modulators GRIN2B, GRIN2A, GRIN2C TGFBR1 1298/4885GRIN2B 1/4885GRIN1 6/4885

“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.