SCHEMBL22988095

SCHEMBL22988095

COc1ccc(-c2nc3c4cccc(C(C)C)c4nc(Cl)n3n2)cc1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.48
ALDH1A1 P00352 2/20 0.48
POLB P06746 1/20 0.48
ADORA3 P0DMS8 11/20 0.45
ADORA1 P30542 5/20 0.43
ADORA2A P29274 4/20 0.43
MAPT P10636 2/20 0.42
THRB P10828 1/20 0.42
XDH P47989 1/20 0.42
KDR P35968 1/20 0.41
LMNA P02545 1/20 0.39
NPC1 O15118 1/20 0.39
TP53 P04637 1/20 0.39
HPGD P15428 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL22988147 0.86 KDM4E (0.52) KDM4EALDH1A1POLBADORA3ADORA1
SCHEMBL22987426 0.85 KDM4E (0.51) KDM4EALDH1A1POLBADORA3ADORA1
SCHEMBL22987552 0.85 KDM4E (0.51) KDM4EALDH1A1POLBADORA3ADORA1
SCHEMBL22987462 0.84 KDM4E (0.50) KDM4EALDH1A1POLBADORA3ADORA1
SCHEMBL22979677 0.84 KDM4E (0.50) KDM4EALDH1A1POLBADORA3ADORA1
SCHEMBL22987710 0.84 KDM4E (0.46) KDM4EALDH1A1POLBADORA3ADORA1
SCHEMBL30393525 0.84 KDM4E (0.46) KDM4EALDH1A1POLBADORA3ADORA1
SCHEMBL22987660 0.82 POLB (0.48) KDM4EALDH1A1POLBADORA3ADORA1
SCHEMBL22979525 0.82 KDM4E (0.48) KDM4EALDH1A1POLBADORA3ADORA1
SCHEMBL22987772 0.82 KDM4E (0.48) KDM4EALDH1A1POLBADORA3ADORA1

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 KDM4E 1364/4885ALDH1A1 597/4885POLB 4033/4885

“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.