SCHEMBL10080322

SCHEMBL10080322

CCCCOc1cc(Br)ccc1OC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.52
NPC1 O15118 2/20 0.52
RAB9A P51151 2/20 0.52
MEN1 O00255 2/20 0.52
LMNA P02545 2/20 0.52
KMT2A Q03164 2/20 0.52
HTT P42858 1/20 0.52
SMPD1 P17405 3/20 0.51
NPSR1 Q6W5P4 1/20 0.48
PDE4B Q07343 4/20 0.47
PDE4A P27815 3/20 0.47
PDE4D Q08499 3/20 0.47
PDE4C Q08493 2/20 0.47
HPGD P15428 2/20 0.46
MAPT P10636 2/20 0.46
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
MAPK1 P28482 2/20 0.45
TNF P01375 1/20 0.45
PDE3B Q13370 1/20 0.45

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
SCHEMBL12264984 0.93 SMN1; SMN2 (0.49) SMN1; SMN2NPC1RAB9AMEN1LMNA
SCHEMBL21823421 0.91 HPGD (0.55) SMN1; SMN2NPC1RAB9ALMNASMPD1
SCHEMBL16362200 0.91 SMN1; SMN2 (0.52) SMN1; SMN2NPC1RAB9AMEN1LMNA
SCHEMBL6502119 0.86 SMPD1 (0.52) SMN1; SMN2NPC1RAB9ASMPD1NPSR1
SCHEMBL842107 0.86 MAPT (0.50) SMN1; SMN2NPC1RAB9ALMNAKMT2A
SCHEMBL29521181 0.86 MAPT (0.50) SMN1; SMN2NPC1RAB9ALMNAKMT2A
SCHEMBL688129 0.86 MAPT (0.46) SMN1; SMN2NPC1RAB9ALMNASMPD1
SCHEMBL1459228 0.85 SMN1; SMN2 (0.54) SMN1; SMN2NPC1RAB9AMEN1LMNA
SCHEMBL8996024 0.85 SMN1; SMN2 (0.46) SMN1; SMN2NPC1RAB9AMEN1LMNA
SCHEMBL21823676 0.84 HTR2A (0.50) SMN1; SMN2NPC1RAB9ALMNASMPD1

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-8148415-B2 Sulfamic acid ester compounds useful in the inhibition of steroid sulphatase activity and aromatase activity STERIX LIMITED (GB) 2012-04-03 US disclosed
US-20070213383-A1 Sulfamic acid ester compounds useful in the inhibition of steroid sulphatase activity and aromatase activity STERIX LIMITED (GB) 2007-09-13 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-20070213383-A1 Sulfamic acid ester compounds useful in the inhibition of steroid sulphatase activity and aromatase activity STS, SULT1E1, CYP19A1 SMN1; SMN2 4413/4885NPC1 4830/4885RAB9A 4324/4885

“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.