SCHEMBL6468693

SCHEMBL6468693

COc1cccc2c(OC(=O)C(F)(F)F)nc(Nc3nc(C)c4ccc(F)c(OC)c4n3)nc12

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 7/20 0.38
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 1/20 0.35
PKM P14618 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CREBBP Q92793 1/20 0.35
KDM4E B2RXH2 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
SCHEMBL6470314 0.93 POLB (0.37) ADORA2APOLBGAAKMT2ASMN1; SMN2
SCHEMBL6470326 0.93 POLB (0.37) ADORA2APOLBGAAKMT2AALDH1A1
SCHEMBL6467457 0.88 ALDH1A1 (0.36) ADORA2APOLBGAAKMT2AALDH1A1
SCHEMBL6468047 0.87 POLB (0.38) ADORA2APOLBGAAKMT2AALDH1A1
SCHEMBL6470299 0.85 ADORA2A (0.36) ADORA2APOLBGAAKMT2AALDH1A1
SCHEMBL6468680 0.85 CXCR6 (0.35) ADORA2APOLBGAAKMT2A
SCHEMBL6466280 0.85 KMT2A (0.37) ADORA2APOLBGAAKMT2AALDH1A1
Trifluoroacetic Acid SCHEMBL6468690 0.84 ADORA2A (0.38) ADORA2APOLBGAAKMT2AALDH1A1
SCHEMBL6469516 0.83 KMT2A (0.42) POLBGAAKMT2AALDH1A1SMN1; SMN2
SCHEMBL6469269 0.81 POLB (0.37) ADORA2APOLBGAAKDM4E

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 4250/4885POLB 3/4885GAA 232/4885

“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.