SCHEMBL3592401

SCHEMBL3592401

CCC(C)(Oc1cc(Br)cc(C(=O)O)c1)OC1CCCCO1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.42
MEN1 O00255 1/20 0.42
CREBBP Q92793 2/20 0.36
EP300 Q09472 1/20 0.34
TSHR P16473 1/20 0.33
HTT P42858 1/20 0.33
NPC1 O15118 1/20 0.32
POLB P06746 1/20 0.32
CYP2C9 P11712 1/20 0.32
RAB9A P51151 1/20 0.32
PLA2G2A P14555 1/20 0.32
CA1 P00915 3/20 0.32
CA2 P00918 3/20 0.32
WDR5 P61964 1/20 0.31
HPGD P15428 2/20 0.31
PTGER4 P35408 1/20 0.31

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
SCHEMBL3601976 0.88 KMT2A (0.41) KMT2AMEN1CREBBPEP300TSHR
SCHEMBL3607261 0.83
SCHEMBL3601973 0.75 KMT2A (0.46) KMT2AMEN1CREBBPEP300PLA2G2A
SCHEMBL3592397 0.74 KMT2A (0.45) KMT2AMEN1CREBBPEP300NPC1
SCHEMBL220900 0.70 KMT2A (0.51) KMT2AMEN1CREBBPEP300PLA2G2A
SCHEMBL16396789 0.69 RAB9A (0.48) KMT2AMEN1TSHRNPC1RAB9A
SCHEMBL16396946 0.69 RAB9A (0.48) KMT2AMEN1TSHRNPC1RAB9A
SCHEMBL17802767 0.69 RAB9A (0.48) KMT2AMEN1TSHRNPC1RAB9A
SCHEMBL3600893 0.68
SCHEMBL3588751 0.68 GCK (0.41) KMT2AMEN1

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-7700640-B2 Process for making phenoxy benzamide compounds ASTRAZENECA AB (SE) 2010-04-20 US disclosed
US-20080200694-A1 Process for Making Phenoxy Benzamide Compounds ASTRAZENECA AB (SE) 2008-08-21 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-20080200694-A1 Process for Making Phenoxy Benzamide Compounds PAH, MAOB, TYR KMT2A 726/4885MEN1 2346/4885CREBBP 390/4885

“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.