SCHEMBL6001975

SCHEMBL6001975

COc1ccc(Nc2nc(-c3ccc(F)cc3)nc3ccccc23)cc1OC

nearest known ligand 0.88

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 18/20 0.88
ABCB1 P08183 11/20 0.88
ABCC1 P33527 5/20 0.88
TP53 P04637 2/20 0.76
MAPT P10636 2/20 0.76
MEN1 O00255 1/20 0.76
LMNA P02545 1/20 0.76
POLB P06746 1/20 0.76
KMT2A Q03164 1/20 0.76
SMN1; SMN2 Q16637 1/20 0.75

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
SCHEMBL22273241 0.94 ABCG2 (1.00) ABCG2ABCB1ABCC1TP53MAPT
SCHEMBL16404295 0.92 ABCG2 (1.00) ABCG2ABCB1ABCC1TP53MAPT
SCHEMBL6001931 0.92 ABCG2 (0.93) ABCG2ABCB1ABCC1TP53MAPT
SCHEMBL16404294 0.87 ABCG2 (0.86) ABCG2ABCB1ABCC1TP53MAPT
SCHEMBL4859258 0.83 ABCG2 (0.80) ABCG2ABCB1ABCC1MEN1KMT2A
SCHEMBL6001826 0.81 ACP1 (0.76) ABCG2ABCB1ABCC1TP53MAPT
SCHEMBL2256504 0.81 ABCG2 (0.73) ABCG2ABCB1ABCC1TP53MAPT
SCHEMBL6001681 0.81 ABCG2 (0.62) ABCG2ABCB1ABCC1TP53MAPT
SCHEMBL4868573 0.80 ABCG2 (1.00) ABCG2ABCC1TP53MAPTMEN1
SCHEMBL3112389 0.80 ABCG2 (0.71) ABCG2ABCB1ABCC1TP53MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060128702-A1 Heterocyclic and bicyclic compounds, compositions and methods REDDY US THERAPEUTICS, INC. 2006-06-15 US 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-20060128702-A1 Heterocyclic and bicyclic compounds, compositions and methods HPSE, ENGASE, UGCG ABCG2 2694/4885ABCB1 2698/4885ABCC1 2721/4885

“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.