SCHEMBL23830223

SCHEMBL23830223

O=C(O)c1cc(Cc2cccnc2)no1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NAPRT Q6XQN6 1/20 0.49
TBXAS1 P24557 13/20 0.48
KMT2A Q03164 2/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
TSHR P16473 1/20 0.44
KDM4E B2RXH2 1/20 0.43
HTT P42858 1/20 0.43
POLB P06746 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MEN1 O00255 1/20 0.42
TP53 P04637 1/20 0.42
CYP3A4 P08684 1/20 0.42
BLM P54132 1/20 0.42

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
SCHEMBL4418768 0.87 RECQL (0.47) NAPRTTBXAS1KMT2ARAB9ASMN1; SMN2
SCHEMBL554742 0.84 SMN1; SMN2 (0.57) RAB9ASMN1; SMN2L3MBTL1
SCHEMBL370074 0.74 CYP2E1 (0.55) KMT2ARAB9ASMN1; SMN2KDM4EMEN1
SCHEMBL30516614 0.74 CYP2E1 (0.55) KMT2ARAB9ASMN1; SMN2KDM4EMEN1
SCHEMBL19556300 0.74 HCAR2 (0.43) RAB9ASMN1; SMN2L3MBTL1
SCHEMBL17967285 0.73 HCAR2 (0.46) RAB9ASMN1; SMN2L3MBTL1
SCHEMBL13403930 0.71 KMO (0.59) NAPRTTBXAS1HTT
SCHEMBL8879575 0.71 SMN1; SMN2 (0.53) KMT2ARAB9ASMN1; SMN2POLBL3MBTL1
SCHEMBL5355415 0.71 SMN1; SMN2 (0.74) KMT2ARAB9ASMN1; SMN2TSHRL3MBTL1
SCHEMBL24208425 0.71 SRD5A2 (0.50) RAB9ASMN1; SMN2KDM4EHTTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240076286-A1 HETEROAROMATIC CARBOXAMIDE DERIVATIVES AS PLASMA KALLIKREIN INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2024-03-07 US disclosed
US-20240002363-A1 HETEROAROMATIC CARBOXAMIDE DERIVATIVES AS PLASMA KALLIKREIN INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2024-01-04 US disclosed
US-11760745-B2 Heteroaromatic carboxamide derivatives as plasma kallikrein inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2023-09-19 US disclosed
US-20210292301-A1 HETEROAROMATIC CARBOXAMIDE DERIVATIVES AS PLASMA KALLIKREIN INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2021-09-23 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 (4 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-20210292301-A1 HETEROAROMATIC CARBOXAMIDE DERIVATIVES AS PLASMA KALLIKREIN INHIBITORS KLKB1, KLK5, KLK1 NAPRT 1757/4885TBXAS1 1022/4885KMT2A 227/4885
US-11760745-B2 Heteroaromatic carboxamide derivatives as plasma kallikrein inhibitors KLKB1, KLK5, KLK1 NAPRT 1757/4885TBXAS1 1022/4885KMT2A 227/4885
US-20240002363-A1 HETEROAROMATIC CARBOXAMIDE DERIVATIVES AS PLASMA KALLIKREIN INHIBITORS KLKB1, KLK5, KLK1 NAPRT 1757/4885TBXAS1 1022/4885KMT2A 227/4885
US-20240076286-A1 HETEROAROMATIC CARBOXAMIDE DERIVATIVES AS PLASMA KALLIKREIN INHIBITORS KLKB1, KLK5, KLK1 NAPRT 1757/4885TBXAS1 1022/4885KMT2A 227/4885

“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.