SCHEMBL851067

SCHEMBL851067

C[C@H](N)[C@H](O)COc1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.66
MAOA P21397 1/20 0.55
PTGS1 P23219 1/20 0.55
SCN4A P35499 2/20 0.53
CYP2D6 P10635 3/20 0.53
ADRB2 P07550 1/20 0.53
ADRB1 P08588 1/20 0.53
ADRB3 P13945 1/20 0.53
MTNR1A P48039 3/20 0.49
MTNR1B P49286 3/20 0.49
L3MBTL1 Q9Y468 1/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
ADRA2A P08913 2/20 0.44
HIF1A Q16665 2/20 0.44
ALDH1A1 P00352 1/20 0.44
CYP1A2 P05177 1/20 0.44
HTR1A P08908 1/20 0.44
DRD1 P21728 1/20 0.44
SLC6A2 P23975 1/20 0.44

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
SCHEMBL835106 1.00 LMNA (0.66) LMNAMAOAPTGS1SCN4ACYP2D6
SCHEMBL851069 1.00 LMNA (0.66) LMNAMAOAPTGS1SCN4ACYP2D6
SCHEMBL10345804 0.85 LMNA (0.61) LMNAMAOAPTGS1SCN4ACYP2D6
SCHEMBL12869056 0.84 LMNA (0.70) LMNAMAOAPTGS1SCN4ACYP2D6
SCHEMBL8187180 0.84 LMNA (0.70) LMNAMAOAPTGS1SCN4ACYP2D6
SCHEMBL9564637 0.83 LMNA (0.68) LMNAMAOAPTGS1SCN4ACYP2D6
SCHEMBL7268804 0.82 LMNA (0.58) LMNAMAOAPTGS1SCN4ACYP2D6
Hydrochloric Acid SCHEMBL7428095 0.81 LMNA (0.56) LMNAMAOAPTGS1SCN4ACYP2D6
SCHEMBL507119 0.79 LMNA (0.63) LMNAMAOAPTGS1SCN4ACYP2D6
SCHEMBL366154 0.79 LMNA (0.63) LMNAMAOAPTGS1SCN4ACYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120252770-A1 Chemical Compounds 572 BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-10-04 US disclosed
US-20120252770-A1 Chemical Compounds 572 BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-10-04 US disclosed
EP-2102169-B1 INDAZOLYL AMIDE DERIVATIVES FOR THE TREATMENT OF GLUCOCORTICOID RECEPTOR MEDIATED DISORDERS ASTRAZENECA AB (SE) 2012-06-20 EP disclosed
US-8143290-B2 Chemical compounds 572 ASTRAZENECA AB (SE) 2012-03-27 US disclosed
US-8143290-B2 Chemical compounds 572 ASTRAZENECA AB (SE) 2012-03-27 US disclosed
US-20110071194-A1 Chemical Compounds 572 BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2011-03-24 US disclosed
US-20110071194-A1 Chemical Compounds 572 BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2011-03-24 US disclosed
US-20100197644-A1 Chemical Compounds 572 BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2010-08-05 US disclosed
US-20100197644-A1 Chemical Compounds 572 BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2010-08-05 US disclosed
US-7728030-B2 Chemical compounds 572 ASTRAZENECA AB (SE) 2010-06-01 US disclosed
US-7728030-B2 Chemical compounds 572 ASTRAZENECA AB (SE) 2010-06-01 US disclosed
US-20080214641-A1 Chemical compounds 572 BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2008-09-04 US disclosed
US-20080214641-A1 Chemical compounds 572 BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2008-09-04 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 (4 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-20080214641-A1 Chemical compounds 572 ABCG2, ABCB1, CYP11B2 LMNA 1618/4885MAOA 995/4885PTGS1 168/4885
US-20100197644-A1 Chemical Compounds 572 ABCG2, ABCB1, CYP11B2 LMNA 1618/4885MAOA 995/4885PTGS1 168/4885
US-20120252770-A1 Chemical Compounds 572 ABCG2, ABCB1, CYP11B2 LMNA 1618/4885MAOA 995/4885PTGS1 168/4885
US-20110071194-A1 Chemical Compounds 572 ABCG2, ABCB1, CYP11B2 LMNA 1618/4885MAOA 995/4885PTGS1 168/4885

“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.