SCHEMBL416295

SCHEMBL416295

O=S(=O)(Nc1ccccc1Oc1ccccc1)c1cc(Cl)ccc1Cl

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACLY P53396 4/20 0.72
PTGDR2 Q9Y5Y4 1/20 0.60
TSHR P16473 2/20 0.59
NPC1 O15118 1/20 0.59
MCL1 Q07820 4/20 0.58
HPGD P15428 1/20 0.57
AR P10275 1/20 0.52
TRIM24 O15164 1/20 0.51
BRD1 O95696 1/20 0.51
BRPF1 P55201 1/20 0.51
PGR P06401 2/20 0.50
ALDH1A1 P00352 1/20 0.50
ALOX12 P18054 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
GPR55 Q9Y2T6 1/20 0.50
MEN1 O00255 1/20 0.49
LMNA P02545 1/20 0.49
MAPT P10636 1/20 0.49
HTT P42858 1/20 0.49
KMT2A Q03164 1/20 0.49

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
SCHEMBL416330 0.87 ACLY (0.62) ACLYPTGDR2TSHRNPC1PGR
SCHEMBL21999965 0.84 ACLY (1.00) ACLYPTGDR2
SCHEMBL13146531 0.80 PGR (0.67) ACLYPTGDR2PGRMEN1KMT2A
SCHEMBL8668137 0.80 TSHR (0.60) ACLYPTGDR2TSHRNPC1MCL1
SCHEMBL13146584 0.77 CCR2 (0.64) ACLYTRIM24BRD1BRPF1PGR
SCHEMBL3558901 0.77 MAPK1 (0.57) ACLYPTGDR2TSHRNPC1MCL1
SCHEMBL4695209 0.76 PPARG (0.69) ACLYPTGDR2
SCHEMBL4517372 0.76 PTGDR2 (1.00) ACLYPTGDR2
SCHEMBL31696798 0.75 MAPK1 (0.70) TSHRMCL1HPGDARPGR
SCHEMBL7572911 0.74 NPC1 (1.00) TSHRNPC1ALDH1A1MEN1KMT2A

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-20120064062-A1 INHIBITORS OF BACTERIAL PLASMINOGEN ACTIVATORS MICROBIOTIX, INC. 2012-03-15 US disclosed
US-20120064062-A1 INHIBITORS OF BACTERIAL PLASMINOGEN ACTIVATORS MICROBIOTIX, INC. 2012-03-15 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-20120064062-A1 INHIBITORS OF BACTERIAL PLASMINOGEN ACTIVATORS PLG, PLAU, TFPI ACLY 2156/4885PTGDR2 1317/4885TSHR 3084/4885

“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.