SCHEMBL22987623

SCHEMBL22987623

O=C1NCCN(C(=O)OCc2ccccc2)C[C@H]1Nc1nc2c(F)cccc2c2nc(-c3cccc(F)c3)nn12

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.42
MAPT P10636 4/20 0.40
LMNA P02545 2/20 0.40
TP53 P04637 2/20 0.39
USP30 Q70CQ3 1/20 0.37
TRPC3 Q13507 1/20 0.36
TRPC7 Q9HCX4 1/20 0.36
GRIN2B Q13224 2/20 0.35
KMT2A Q03164 1/20 0.35
JAK2 O60674 3/20 0.34
JAK1 P23458 3/20 0.34
TYK2 P29597 2/20 0.34
JAK3 P52333 2/20 0.34
PARP1 P09874 1/20 0.34
ENPP2 Q13822 1/20 0.33

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
SCHEMBL22987683 0.94 TRPC3 (0.40) RXFP1MAPTLMNATP53USP30
SCHEMBL22987919 0.93 MAPT (0.39) RXFP1MAPTLMNATP53USP30
SCHEMBL22987628 0.93 MAPT (0.39) RXFP1MAPTLMNATP53USP30
SCHEMBL22987465 0.93 TP53 (0.39) RXFP1MAPTLMNATP53USP30
SCHEMBL22988052 0.92 MAPT (0.42) RXFP1MAPTLMNATP53USP30
SCHEMBL25118867 0.90 ADORA3 (0.40) MAPTTP53TRPC3TRPC7PARP1
SCHEMBL22988171 0.90 ADORA3 (0.35) RXFP1USP30TRPC3TRPC7KMT2A
SCHEMBL22988001 0.88 NR1H2 (0.33) RXFP1MAPTTP53USP30TRPC3
SCHEMBL22988270 0.88 USP30 (0.34) RXFP1USP30TRPC3TRPC7KMT2A
SCHEMBL30393069 0.88 USP30 (0.34) RXFP1USP30TRPC3TRPC7KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230113037-A1 [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINES BAYER AKTIENGESELLSCHAFT (DE) 2023-04-13 US 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 RXFP1 154/4885MAPT 4047/4885LMNA 2937/4885

“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.