SCHEMBL4834816

SCHEMBL4834816

COc1ccc2c(c1)C(=CC(=O)c1ccc(NC(=O)c3cccc(F)c3)cc1)NC(C)(C)C2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.49
MEN1 O00255 5/20 0.49
POLB P06746 1/20 0.49
TP53 P04637 4/20 0.44
MAPT P10636 2/20 0.44
ALDH1A1 P00352 3/20 0.44
KDM4E B2RXH2 2/20 0.44
NPC1 O15118 7/20 0.43
RAB9A P51151 7/20 0.43
SMN1; SMN2 Q16637 5/20 0.43
PKM P14618 1/20 0.43
HPGD P15428 1/20 0.43
MAPK1 P28482 1/20 0.43
NFKB1 P19838 2/20 0.42
NFKB2 Q00653 2/20 0.42
RELA Q04206 2/20 0.42
HTT P42858 1/20 0.42
TSHR P16473 1/20 0.41
AR P10275 1/20 0.41
LMNA P02545 1/20 0.41

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
SCHEMBL4834806 1.00 KMT2A (0.49) KMT2AMEN1POLBTP53MAPT
SCHEMBL4844733 0.93 KMT2A (0.44) KMT2AMEN1POLBTP53MAPT
SCHEMBL4844740 0.93 KMT2A (0.44) KMT2AMEN1POLBTP53MAPT
SCHEMBL4837792 0.93 KMT2A (0.51) KMT2AMEN1POLBTP53MAPT
SCHEMBL4837807 0.93 KMT2A (0.51) KMT2AMEN1POLBTP53MAPT
SCHEMBL4835328 0.91 KMT2A (0.44) KMT2AMEN1POLBTP53MAPT
SCHEMBL4835312 0.91 KMT2A (0.44) KMT2AMEN1POLBTP53MAPT
SCHEMBL4844423 0.91 RAB9A (0.47) KMT2AMEN1POLBTP53MAPT
SCHEMBL4843022 0.91 KCNK3 (0.49) KMT2AMEN1TP53MAPTALDH1A1
SCHEMBL4844433 0.91 RAB9A (0.47) KMT2AMEN1POLBTP53MAPT

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-7378428-B2 Nitrogen-containing bicyclic compounds and drugs containing the same as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2008-05-27 US disclosed
US-20050222138-A1 Nitrogen-containing bicyclic compounds and drugs containing the same as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2005-10-06 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-20050222138-A1 Nitrogen-containing bicyclic compounds and drugs containing the same as the active ingredient PARK7, MMP8, CDK7 KMT2A 4642/4885MEN1 1230/4885POLB 856/4885

“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.