SCHEMBL496381

SCHEMBL496381

N[C@H](Cc1ccccc1)[C@@H](O)CN1CCc2ccccc2C1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 14/20 0.56
WDR77 Q9BQA1 14/20 0.56
CARM1 Q86X55 1/20 0.51
HDAC8 Q9BY41 1/20 0.51
LMNA P02545 1/20 0.50
HTT P42858 1/20 0.50

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
Hydrochloric Acid SCHEMBL495605 0.99 PRMT5 (0.55) PRMT5WDR77CARM1HDAC8LMNA
SCHEMBL495855 0.90 HDAC8 (0.50) PRMT5WDR77CARM1HDAC8
Hydrochloric Acid SCHEMBL496040 0.89 HDAC8 (0.51) PRMT5WDR77CARM1HDAC8
SCHEMBL24306794 0.81 CARM1 (0.61) PRMT5WDR77CARM1LMNAHTT
SCHEMBL495874 0.80 CSNK1E (0.48)
SCHEMBL12635754 0.79 HDAC8 (0.43) PRMT5WDR77HDAC8
SCHEMBL12635740 0.79 CSNK1E (0.43) PRMT5WDR77CARM1HDAC8
SCHEMBL12635744 0.79 CSNK1E (0.43) PRMT5WDR77CARM1HDAC8
SCHEMBL496919 0.79 TSHR (0.47)
Hydrochloric Acid SCHEMBL496018 0.79 CSNK1E (0.47) HTT

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
EP-1910317-B1 1-AMINO LINKED COMPOUNDS LILLY CO ELI (US) 2013-07-03 EP disclosed
EP-1910317-B1 1-AMINO LINKED COMPOUNDS LILLY CO ELI (US) 2013-07-03 EP disclosed
US-8106090-B2 Antidiabetic agents; prevent of non-insulin dependent diabetes ELI LILLY AND COMPANY (US) 2012-01-31 US disclosed
US-8106090-B2 Antidiabetic agents; prevent of non-insulin dependent diabetes ELI LILLY AND COMPANY (US) 2012-01-31 US disclosed
US-8106090-B2 Antidiabetic agents; prevent of non-insulin dependent diabetes ELI LILLY AND COMPANY (US) 2012-01-31 US disclosed
US-20080207735-A1 1-Amino Linked Compounds ELI LILLY AND COMPANY 2008-08-28 US disclosed
US-20080207735-A1 1-Amino Linked Compounds ELI LILLY AND COMPANY 2008-08-28 US disclosed
US-20080207735-A1 1-Amino Linked Compounds ELI LILLY AND COMPANY 2008-08-28 US disclosed
WO-2007015805-A1 1-AMINO LINKED COMPOUNDS ELI LILLY AND COMPANY (US) 2007-02-08 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-20080207735-A1 1-Amino Linked Compounds DPP4, DPP3, DPP9 PRMT5 1142/4885WDR77 1223/4885CARM1 1191/4885

“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.