SCHEMBL7206841

SCHEMBL7206841

C=CCNP(=O)(OCC(=O)OCC)c1ccc(Oc2ccc(Cl)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.43
RAB9A P51151 2/20 0.37
GAA P10253 2/20 0.37
GLA P06280 1/20 0.37
HTT P42858 1/20 0.37
NPC1 O15118 1/20 0.37
HPGD P15428 1/20 0.37
CRHBP P24387 1/20 0.37
CRHR2 Q13324 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
MAPT P10636 2/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
PTGS2 P35354 1/20 0.36
CYP1A2 P05177 2/20 0.36
CYP3A4 P08684 2/20 0.36
CYP2C19 P33261 1/20 0.36
PMP22 Q01453 2/20 0.35
ABCB11 O95342 1/20 0.35

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
SCHEMBL6546064 0.80 RAB9A (0.44) SMN1; SMN2RAB9AGAAGLAHTT
SCHEMBL6546178 0.72 ALDH1A1 (0.41) SMN1; SMN2RAB9AGAANPC1MEN1
SCHEMBL24806572 0.71 GAA (0.60) GAAHPGDMAPTLMNAPOLB
SCHEMBL6546182 0.67 MAPT (0.44) SMN1; SMN2RAB9AGAANPC1HPGD
SCHEMBL6545725 0.67 BCL2A1 (0.38) SMN1; SMN2GAAMEN1KMT2AMAPT
SCHEMBL5207122 0.66 GAA (0.66) SMN1; SMN2GAAHPGDMAPTLMNA
SCHEMBL11087771 0.66 MMP1 (0.55) SMN1; SMN2HPGDMEN1KMT2AMAPT
SCHEMBL5411982 0.65 POLB (0.62) SMN1; SMN2RAB9AGAAHTTNPC1
SCHEMBL6545599 0.65 MAOA (0.38) SMN1; SMN2GAAHPGDMEN1KMT2A
SCHEMBL21991515 0.64 TDP1 (0.50) KMT2AMAPTLMNACYP1A2CYP3A4

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-6605742-B2 Rheumatic diseases; antiarthritic agents; antitumor agents LEO PHARMA A/S (DK) 2003-08-12 US disclosed
US-20020177706-A1 Novel cyclo azaphospha hydrocarbons LEO PHARMA A/S (DK) 2002-11-28 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-20020177706-A1 Novel cyclo azaphospha hydrocarbons CMA1, MMP9, CPA1 SMN1; SMN2 4648/4885RAB9A 2774/4885GAA 701/4885

“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.