SCHEMBL23112623

SCHEMBL23112623

CCOC(=O)c1cc2c(=O)[nH]c(-c3ccc(Cl)c(Cl)c3)cn2n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA2 P47869 5/20 0.47
GABRB2 P47870 5/20 0.47
NOTUM Q6P988 1/20 0.46
TNKS O95271 1/20 0.45
PARP1 P09874 1/20 0.45
TNKS2 Q9H2K2 1/20 0.45
TEAD2 Q15562 1/20 0.45
ADORA3 P0DMS8 1/20 0.43
SPR P35270 1/20 0.42
SLC6A2 P23975 1/20 0.42
SLC6A4 P31645 1/20 0.42
SLC6A3 Q01959 1/20 0.42
PTGES O14684 1/20 0.41
ALOX5 P09917 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
CASP1 P29466 1/20 0.41

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
SCHEMBL23112429 0.93 TNKS (0.44) GABRA2GABRB2NOTUMTNKSPARP1
SCHEMBL23112293 0.87 TNKS (0.47) GABRA2GABRB2TNKSPARP1TNKS2
SCHEMBL23112559 0.84 PPP1CA (0.45) TNKSPARP1TNKS2
SCHEMBL23112639 0.84 ADORA3 (0.47) GABRA2GABRB2TNKSPARP1TNKS2
SCHEMBL29976868 0.84 TNKS (0.44) GABRA2GABRB2TNKSPARP1TNKS2
SCHEMBL29977130 0.84 ADORA3 (0.47) GABRA2GABRB2TNKSPARP1TNKS2
SCHEMBL23112619 0.84 TNKS (0.44) GABRA2GABRB2TNKSPARP1TNKS2
SCHEMBL23112455 0.84 TNKS (0.44) GABRA2GABRB2TNKSPARP1TNKS2
SCHEMBL23112708 0.84 TNKS (0.44) GABRA2GABRB2TNKSPARP1TNKS2
SCHEMBL1513997 0.83 KDM4E (0.46) GABRA2GABRB2ADORA3SPRKDM4E

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 GABRA2 2451/4885GABRB2 2971/4885NOTUM 2577/4885

“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.