SCHEMBL22987803

SCHEMBL22987803

O=C1NCCN(C(=O)OCc2ccccc2)C[C@@H]1Nc1nc2ccccc2c2nc(-c3ccc(F)cc3)nn12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPC3 Q13507 1/20 0.41
TRPC7 Q9HCX4 1/20 0.41
MAPT P10636 4/20 0.41
KMT2A Q03164 4/20 0.41
ADORA3 P0DMS8 4/20 0.40
GAA P10253 4/20 0.40
TP53 P04637 3/20 0.40
ADORA2A P29274 3/20 0.40
ADORA1 P30542 3/20 0.40
ALPL P05186 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
HCRTR1 O43613 3/20 0.39
HTT P42858 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
POLB P06746 1/20 0.39
LMNA P02545 2/20 0.38
ALPI P09923 1/20 0.38
ALPG P10696 1/20 0.38
TNKS O95271 1/20 0.38

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
SCHEMBL22987937 1.00 TRPC3 (0.41) TRPC3TRPC7MAPTKMT2AADORA3
SCHEMBL30393771 1.00 TRPC3 (0.41) TRPC3TRPC7MAPTKMT2AADORA3
SCHEMBL22988052 0.93 MAPT (0.42) TRPC3TRPC7MAPTKMT2AGAA
SCHEMBL22987938 0.92 ADORA3 (0.41) TRPC3TRPC7MAPTKMT2AADORA3
SCHEMBL22987683 0.92 TRPC3 (0.40) TRPC3TRPC7MAPTKMT2AADORA3
SCHEMBL22979870 0.91 MAPT (0.48) MAPTKMT2AADORA3GAATP53
SCHEMBL22987640 0.91 MAPT (0.40) MAPTKMT2AGAATP53ALPL
SCHEMBL29646384 0.91 MAPT (0.48) MAPTKMT2AADORA3GAATP53
SCHEMBL22987879 0.91 MAPT (0.40) MAPTKMT2AGAATP53ALPL
SCHEMBL22987501 0.90 TRPC3 (0.39) TRPC3TRPC7MAPTKMT2AADORA3

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 TRPC3 905/4885TRPC7 953/4885MAPT 4047/4885

“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.