SCHEMBL4665846

SCHEMBL4665846

COc1ccc(S(=O)(=O)Nc2ccc(Nc3cc(-c4ccccc4)ncn3)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 5/20 0.59
MEN1 O00255 2/20 0.58
KMT2A Q03164 2/20 0.58
NPC1 O15118 1/20 0.58
RAB9A P51151 1/20 0.58
PGR P06401 1/20 0.56
TSHR P16473 2/20 0.55
USP2 O75604 1/20 0.55
CYP1A2 P05177 1/20 0.55
CYP3A4 P08684 1/20 0.55
CYP2D6 P10635 1/20 0.55
CYP2C9 P11712 1/20 0.55
CYP2C19 P33261 1/20 0.55
CLK4 Q9HAZ1 1/20 0.55
TNNI3K Q59H18 1/20 0.54
ABL1 P00519 3/20 0.54
BCR P11274 3/20 0.54
NPY5R Q15761 1/20 0.54
PLAU P00749 1/20 0.54
ADORA3 P0DMS8 1/20 0.54

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
SCHEMBL4098721 0.90 NPY5R (0.57) MEN1KMT2ATNNI3KABL1BCR
SCHEMBL4665854 0.88 BACE1 (0.60) BACE1MEN1KMT2ATSHRUSP2
SCHEMBL4109389 0.85 EGFR (0.54) BACE1MEN1KMT2ANPC1RAB9A
SCHEMBL4665753 0.85 BACE1 (0.55) BACE1PGRTSHRUSP2CYP1A2
SCHEMBL4663985 0.85 ABL1 (0.61) PGRUSP2TNNI3KABL1BCR
SCHEMBL5863265 0.83 ABL1 (0.69) TSHRUSP2CYP1A2CYP3A4CYP2D6
SCHEMBL4098113 0.83 USP2 (0.63) BACE1USP2CYP1A2CYP2D6CYP2C19
SCHEMBL4663960 0.83 ABL1 (0.57) BACE1MEN1KMT2ANPC1RAB9A
SCHEMBL4664273 0.83 ABCG2 (0.53) BACE1TSHRUSP2CYP1A2CYP3A4
SCHEMBL4666199 0.82 AR (0.69) BACE1MEN1KMT2APGRABL1

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-20080242681-A1 N-4-(6-(Hetero)Aryl-Pyrimidin-4-Ylaminophenyl)-Benzenesulfonamides as Kinase Inhibitors ALTANA PHARMA AG (DE) 2008-10-02 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-20080242681-A1 N-4-(6-(Hetero)Aryl-Pyrimidin-4-Ylaminophenyl)-Benzenesulfonamides as Kinase Inhibitors MAP3K19, MAP3K6, MAP3K20 BACE1 4299/4885MEN1 3892/4885KMT2A 997/4885

“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.