SCHEMBL17867480

SCHEMBL17867480

COc1ccc2ccccc2[n+]1CC(=O)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 10/20 0.51
MEN1 O00255 5/20 0.51
ALDH1A1 P00352 4/20 0.51
KDM4E B2RXH2 4/20 0.45
HTT P42858 3/20 0.45
LMNA P02545 2/20 0.45
ALPG P10696 1/20 0.45
HPGD P15428 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
ATM Q13315 2/20 0.41
RECQL P46063 1/20 0.41
USP2 O75604 1/20 0.40
APOBEC3A P31941 1/20 0.40
KEAP1 Q14145 1/20 0.40
NFE2L2 Q16236 1/20 0.40
APOBEC3G Q9HC16 1/20 0.40
NPC1 O15118 2/20 0.39
MAPT P10636 2/20 0.39
RAB9A P51151 1/20 0.39
POLB P06746 2/20 0.39

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
Bromide SCHEMBL1645657 0.79 KMT2A (0.57) KMT2AMEN1ALDH1A1KDM4EHTT
SCHEMBL764729 0.77 KMT2A (0.57) KMT2AMEN1ALDH1A1KDM4EHTT
SCHEMBL7042998 0.75 MEN1 (0.48) KMT2AMEN1ALDH1A1KDM4EHTT
SCHEMBL27874112 0.72 KMT2A (0.51) KMT2AMEN1ALDH1A1KDM4EHTT
SCHEMBL11395397 0.72 KMT2A (0.51) KMT2AMEN1ALDH1A1KDM4EHTT
SCHEMBL9645612 0.70 MEN1 (0.41) KMT2AMEN1ALDH1A1KDM4EHTT
SCHEMBL5684840 0.69 HPGD (0.51) KMT2AMEN1ALDH1A1KDM4EHTT
SCHEMBL1128535 0.69 KMT2A (0.97) KMT2AMEN1ALDH1A1KDM4EHTT
SCHEMBL30636590 0.69 KMT2A (0.97) KMT2AMEN1ALDH1A1KDM4EHTT
Bromide SCHEMBL6228650 0.68 KMT2A (1.00) KMT2AMEN1ALDH1A1KDM4EHTT

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-20160185725-A1 c-Met Modulators and Method of Use EXELIXIS, INC. 2016-06-30 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-20160185725-A1 c-Met Modulators and Method of Use FLT4, MET, FLT1 KMT2A 769/4885MEN1 1333/4885ALDH1A1 2578/4885

“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.