SCHEMBL22987875

SCHEMBL22987875

COc1cccc(-c2nc3c4ccc(F)cc4nc(Cl)n3n2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
ADORA3 P0DMS8 3/20 0.44
ABCG2 Q9UNQ0 3/20 0.43
PIK3CA P42336 1/20 0.42
NR1H2 P55055 1/20 0.42
NR1H3 Q13133 1/20 0.42
ABCB1 P08183 1/20 0.41
PRKCA P17252 1/20 0.41
GSK3B P49841 1/20 0.41
LMNA P02545 1/20 0.41
CSNK1D P48730 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
VDR P11473 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2B6 P20813 1/20 0.40
AHR P35869 1/20 0.40
NR1I3 Q14994 1/20 0.40
PDGFRB P09619 1/20 0.40

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
SCHEMBL22987471 0.91 MAPT (0.45) MAPTSMN1; SMN2ADORA3ABCG2PIK3CA
SCHEMBL22987485 0.88 MAPT (0.52) MAPTSMN1; SMN2ADORA3NR1H2NR1H3
SCHEMBL22987874 0.88 ADORA3 (0.56) MAPTSMN1; SMN2ADORA3LMNAADORA2A
SCHEMBL22979197 0.86 MAPT (0.57) MAPTSMN1; SMN2ADORA3ABCG2NR1H2
SCHEMBL29646448 0.86 MAPT (0.57) MAPTSMN1; SMN2ADORA3ABCG2NR1H2
SCHEMBL22987469 0.81 MAPT (0.52) MAPTSMN1; SMN2ADORA3NR1H2NR1H3
SCHEMBL22987478 0.81 NR1H2 (0.42) MAPTSMN1; SMN2ADORA3ABCG2NR1H2
SCHEMBL22987910 0.80 ADORA3 (0.60) MAPTSMN1; SMN2ADORA3ADORA2A
SCHEMBL30393887 0.79 MAPT (0.45) MAPTSMN1; SMN2ABCG2PIK3CANR1H2
SCHEMBL22988146 0.79 ADORA3 (0.53) MAPTADORA3ADORA2A

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 MAPT 4047/4885SMN1; SMN2 4234/4885ADORA3 34/4885

“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.