SCHEMBL4299181

SCHEMBL4299181

O=c1ccc2ccccc2n1OCC(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.43
BRD4 O60885 1/20 0.43
BRPF1 P55201 1/20 0.43
CA9 Q16790 1/20 0.43
KAT2B Q92831 1/20 0.43
BRD9 Q9H8M2 1/20 0.43
HDAC1 Q13547 3/20 0.38
HDAC6 Q9UBN7 3/20 0.38
HDAC8 Q9BY41 2/20 0.38
KMT2A Q03164 3/20 0.36
ALDH1A1 P00352 3/20 0.34
KDM4E B2RXH2 2/20 0.34
MEN1 O00255 2/20 0.34
LMNA P02545 3/20 0.33
PKM P14618 1/20 0.33
DRD2 P14416 1/20 0.33
DRD3 P35462 1/20 0.33
MAPK1 P28482 1/20 0.33
TSHR P16473 2/20 0.33
POLB P06746 1/20 0.32

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
SCHEMBL31324227 0.78 CA12 (0.47) CA12BRD4BRPF1CA9KAT2B
SCHEMBL16896766 0.78 CA12 (0.47) CA12BRD4BRPF1CA9KAT2B
SCHEMBL9284377 0.75 ALDH1A1 (0.58) CA12BRD4BRPF1CA9KAT2B
SCHEMBL10661265 0.75 CA12 (0.55) CA12BRD4BRPF1CA9KAT2B
SCHEMBL8071670 0.74 ALOX15 (0.52) CA12BRD4BRPF1CA9KAT2B
SCHEMBL22091027 0.73 CA12 (0.42) CA12BRD4BRPF1CA9KAT2B
SCHEMBL29433205 0.73 TDP1 (0.47) CA12BRD4BRPF1CA9KAT2B
SCHEMBL30925613 0.72 CA12 (0.41) CA12BRD4BRPF1CA9KAT2B
SCHEMBL28498048 0.72 CA12 (0.41) CA12BRD4BRPF1CA9KAT2B
SCHEMBL30704385 0.72 CA12 (0.41) CA12BRD4BRPF1CA9KAT2B

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-20090281100-A1 Benzimidazole quinolinones and uses thereof BARSANTI PAUL A 2009-11-12 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-20090281100-A1 Benzimidazole quinolinones and uses thereof GAA, ALPI, IL4I1 CA12 1203/4885BRD4 697/4885BRPF1 2923/4885

“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.