SCHEMBL23112586

SCHEMBL23112586

CCOC(=O)c1cc(C(=O)OCC)n(CC(=O)c2ccc(Br)c(C)c2)n1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.41
CYP1A2 P05177 1/20 0.39
SMN1; SMN2 Q16637 6/20 0.38
KMT2A Q03164 3/20 0.38
POLB P06746 2/20 0.38
MEN1 O00255 1/20 0.38
GAA P10253 2/20 0.38
ALDH1A1 P00352 1/20 0.37
NPC1 O15118 4/20 0.37
RAB9A P51151 4/20 0.37
KDM4E B2RXH2 2/20 0.37
TP53 P04637 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ELANE P08246 1/20 0.36

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
SCHEMBL29977114 0.91 HPGD (0.40) MAPTSMN1; SMN2KMT2APOLBMEN1
SCHEMBL23112275 0.91 HPGD (0.40) MAPTSMN1; SMN2KMT2APOLBMEN1
SCHEMBL29977154 0.90 SMN1; SMN2 (0.46) MAPTCYP1A2SMN1; SMN2KMT2APOLB
SCHEMBL28560572 0.90 SMN1; SMN2 (0.46) MAPTCYP1A2SMN1; SMN2KMT2APOLB
SCHEMBL29977448 0.84 GAA (0.42) MAPTSMN1; SMN2KMT2APOLBMEN1
SCHEMBL23112584 0.84 SMN1; SMN2 (0.51) MAPTSMN1; SMN2KMT2APOLBMEN1
SCHEMBL28542240 0.84 GAA (0.42) MAPTSMN1; SMN2KMT2APOLBMEN1
SCHEMBL28546956 0.84 SMN1; SMN2 (0.40) MAPTCYP1A2SMN1; SMN2KMT2APOLB
SCHEMBL29977159 0.84 MAPT (0.38) MAPTSMN1; SMN2KMT2APOLBMEN1
SCHEMBL28912090 0.84 BRAF (0.41) MAPTSMN1; SMN2KMT2APOLBMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220324865-A1 SUBSTITUTED DIHYDROPYRAZOLO PYRAZINE CARBOXAMIDE DERIVATIVES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2022-10-13 US disclosed
EP-3793559-A1 SUBSTITUTED DIHYDROPYRAZOLO PYRAZINE CARBOXAMIDE DERIVATIVES Bayer Aktiengesellschaft (DE) 2021-03-24 EP disclosed
CN-112469412-A Substituted dihydropyrazolopyrazine carboxamide derivatives 拜耳公司 2021-03-09 CN 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-20220324865-A1 SUBSTITUTED DIHYDROPYRAZOLO PYRAZINE CARBOXAMIDE DERIVATIVES QDPR, SIRT5, PDXK MAPT 3520/4885CYP1A2 191/4885SMN1; SMN2 3131/4885

“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.