SCHEMBL22987946

SCHEMBL22987946

CCOC(=O)Nc1c(C#N)cccc1OC

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.53
ALDH1A1 P00352 3/20 0.53
KDM4E B2RXH2 3/20 0.53
HSD17B10 Q99714 2/20 0.53
NLRP3 Q96P20 5/20 0.51
L3MBTL1 Q9Y468 2/20 0.48
GAA P10253 1/20 0.48
RAB9A P51151 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
HPGD P15428 1/20 0.45
MTNR1B P49286 1/20 0.45
NPC1 O15118 2/20 0.44
MAPK1 P28482 1/20 0.44
HTT P42858 1/20 0.44
NPSR1 Q6W5P4 2/20 0.44
MAPT P10636 1/20 0.44
KMT2A Q03164 1/20 0.44
GLA P06280 1/20 0.44
POLB P06746 1/20 0.44
IMPDH2 P12268 1/20 0.43

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
SCHEMBL22979105 0.84 IMPDH2 (0.48) TSHRALDH1A1L3MBTL1GAARAB9A
SCHEMBL7976076 0.82 NLRP3 (0.60) ALDH1A1KDM4EHSD17B10NLRP3L3MBTL1
SCHEMBL29649048 0.82 NLRP3 (0.60) ALDH1A1KDM4EHSD17B10NLRP3L3MBTL1
SCHEMBL29648979 0.82 NLRP3 (0.52) ALDH1A1KDM4EHSD17B10NLRP3L3MBTL1
SCHEMBL22987464 0.82 NLRP3 (0.52) ALDH1A1KDM4EHSD17B10NLRP3L3MBTL1
SCHEMBL22987863 0.82 NLRP3 (0.60) ALDH1A1KDM4EHSD17B10NLRP3L3MBTL1
SCHEMBL22988091 0.80 NLRP3 (0.62) ALDH1A1KDM4ENLRP3L3MBTL1GAA
SCHEMBL22987663 0.80 NLRP3 (0.50) TSHRALDH1A1KDM4EHSD17B10NLRP3
SCHEMBL30542576 0.80 KMT2A (0.48) TSHRALDH1A1KDM4EHSD17B10GAA
SCHEMBL22987965 0.79 NLRP3 (0.49) ALDH1A1KDM4EHSD17B10NLRP3L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114466850-B [1,2,4] Triazolo [1,5-C ] quinazolin-5-amine 拜耳股份有限公司 2024-09-10 CN disclosed
US-20230113037-A1 [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINES BAYER AKTIENGESELLSCHAFT (DE) 2023-04-13 US disclosed
US-20230113037-A1 [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINES BAYER AKTIENGESELLSCHAFT (DE) 2023-04-13 US disclosed
EP-4013508-A1 [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINES Bayer Aktiengesellschaft (DE) 2022-06-22 EP disclosed
CN-114466850-A [1,2,4] triazolo [1,5-C ] quinazolin-5-amines 拜耳股份有限公司 2022-05-10 CN disclosed
WO-2021028382-A1 [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINES BAYER AKTIENGESELLSCHAFT (DE) 2021-02-18 WO 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-20230113037-A1 [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINES AHR, HRH4, HRH1 TSHR 838/4885ALDH1A1 597/4885KDM4E 1364/4885

“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.