SCHEMBL5010631

SCHEMBL5010631

O=C(c1cccc(C(F)(F)F)c1)N1CCN(C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)CC1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 2/20 0.62
POLB P06746 2/20 0.60
LMNA P02545 2/20 0.60
HPGD P15428 1/20 0.60
SMN1; SMN2 Q16637 2/20 0.55
CACNA2D1 P54289 1/20 0.54
CACNA1B Q00975 1/20 0.54
CACNB1 Q02641 1/20 0.54
CACNA1C Q13936 1/20 0.54
MAOB P27338 1/20 0.53
ABHD6 Q9BV23 1/20 0.53
RBP4 P02753 1/20 0.52
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
GPX4 P36969 2/20 0.50
KCNK3 O14649 1/20 0.50
KCNK9 Q9NPC2 1/20 0.50
MAPT P10636 1/20 0.49
NPY2R P49146 1/20 0.49
ABL1 P00519 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
SCHEMBL5010693 0.89 RHOC (0.61) MGLLCACNA2D1CACNA1BCACNB1CACNA1C
SCHEMBL5011593 0.84 TSHR (0.64) MGLLLMNASMN1; SMN2MAOBGPX4
SCHEMBL5009483 0.81 USP2 (0.70) MGLLLMNASMN1; SMN2CACNA2D1CACNA1B
SCHEMBL13503897 0.80 LMNA (0.68) MGLLPOLBLMNAHPGDSMN1; SMN2
SCHEMBL9514284 0.77 LMNA (0.61) MGLLPOLBLMNAHPGDSMN1; SMN2
Hydrochloric Acid SCHEMBL9514278 0.76 LMNA (0.60) MGLLPOLBLMNAHPGDSMN1; SMN2
SCHEMBL5014235 0.76 HSP90AA1 (0.64) MGLLPOLBCACNA2D1CACNA1BCACNB1
SCHEMBL5011761 0.76 CACNA2D1 (0.56) MGLLLMNACACNA2D1CACNA1BCACNB1
SCHEMBL13503960 0.76 POLB (0.74) MGLLPOLBLMNAHPGDSMN1; SMN2
SCHEMBL2295165 0.76 LMNA (0.74) MGLLPOLBLMNAHPGDSMN1; SMN2

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080306087-A1 Therapeutic Agents ASTRAZENECA AB (SE) 2008-12-11 US claimed
EP-1915355-A1 THERAPEUTIC AGENTS AstraZeneca AB (SE) 2008-04-30 EP claimed
WO-2007018459-A1 THERAPEUTIC AGENTS ASTRAZENECA AB (SE) 2007-02-15 WO claimed
US-20080306087-A1 Therapeutic Agents ASTRAZENECA AB (SE) 2008-12-11 US disclosed
US-20080306087-A1 Therapeutic Agents ASTRAZENECA AB (SE) 2008-12-11 US disclosed
US-20080306087-A1 Therapeutic Agents ASTRAZENECA AB (SE) 2008-12-11 US disclosed
EP-1915355-A1 THERAPEUTIC AGENTS AstraZeneca AB (SE) 2008-04-30 EP disclosed
WO-2007018459-A1 THERAPEUTIC AGENTS ASTRAZENECA AB (SE) 2007-02-15 WO disclosed
WO-2007018459-A1 THERAPEUTIC AGENTS ASTRAZENECA AB (SE) 2007-02-15 WO 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-20080306087-A1 Therapeutic Agents NLN, BDNF, GAP43 MGLL 639/4885POLB 3211/4885LMNA 2303/4885

“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.