SCHEMBL6470299

SCHEMBL6470299

COCCOc1c(OC)ccc2c(C)nc(Nc3nc(OC(=O)C(F)(F)F)c4cccc(OC)c4n3)nc12

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 13/20 0.36
GAA P10253 2/20 0.35
POLB P06746 1/20 0.35
ALDH1A1 P00352 1/20 0.35
PKM P14618 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CREBBP Q92793 1/20 0.35

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
SCHEMBL6470326 0.90 POLB (0.37) ADORA2AGAAPOLBALDH1A1PKM
SCHEMBL6465702 0.86 ADORA2A (0.39) ADORA2AALDH1A1PKMKMT2ASMN1; SMN2
SCHEMBL6468661 0.86 BRAF (0.39) ADORA2A
Trifluoroacetic Acid SCHEMBL6470296 0.86 GAA (0.36) ADORA2AGAAPOLBALDH1A1PKM
SCHEMBL6468693 0.85 ADORA2A (0.38) ADORA2AGAAPOLBALDH1A1PKM
SCHEMBL6470468 0.85 ADORA2A (0.39) ADORA2AGAAALDH1A1KMT2ASMN1; SMN2
SCHEMBL6468047 0.83 POLB (0.38) ADORA2AGAAPOLBALDH1A1PKM
SCHEMBL6467457 0.83 ALDH1A1 (0.36) ADORA2AGAAPOLBALDH1A1PKM
SCHEMBL6469516 0.81 KMT2A (0.42) GAAPOLBALDH1A1KMT2ASMN1; SMN2
SCHEMBL6469269 0.80 POLB (0.37) ADORA2AGAAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050124562-A1 Bis-quinazoline compounds for the treatment of bacterial infections REPLIDYNE, INC. 2005-06-09 US claimed
WO-2005030131-A2 BIS-QUINAZOLINE COMPOUNDS FOR THE TREATMENT OF BACTERIAL INFECTIONS REPLIDYNE, INC (US) 2005-04-07 WO claimed
US-20050124562-A1 Bis-quinazoline compounds for the treatment of bacterial infections REPLIDYNE, INC. 2005-06-09 US disclosed
WO-2005030131-A2 BIS-QUINAZOLINE COMPOUNDS FOR THE TREATMENT OF BACTERIAL INFECTIONS REPLIDYNE, INC (US) 2005-04-07 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-20050124562-A1 Bis-quinazoline compounds for the treatment of bacterial infections POLI, POLK, POLB ADORA2A 4250/4885GAA 232/4885POLB 3/4885

“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.