SCHEMBL2372910

SCHEMBL2372910

CCc1ccccc1N(C(C)=O)c1ccccc1CC

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.56
NPSR1 Q6W5P4 2/20 0.49
PTPN1 P18031 4/20 0.43
GABRA1 P14867 2/20 0.41
GABRB2 P47870 2/20 0.41
GAA P10253 2/20 0.41
MGLL Q99685 1/20 0.38
ALDH1A1 P00352 1/20 0.36
TP53 P04637 1/20 0.36
MAPT P10636 1/20 0.36
TSHR P16473 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TSPO P30536 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL9931971 0.91 LMNA (0.50) LMNANPSR1PTPN1ALDH1A1TP53
SCHEMBL7985518 0.89 LMNA (0.51) LMNANPSR1PTPN1ALDH1A1TP53
SCHEMBL12501297 0.83 LMNA (0.46) LMNANPSR1PTPN1GABRA1GABRB2
SCHEMBL7978939 0.82 LMNA (0.49) LMNANPSR1ALDH1A1TP53MAPT
SCHEMBL8061230 0.82 LMNA (0.44) LMNANPSR1PTPN1GABRA1GABRB2
SCHEMBL27320089 0.82 TSHR (0.47) LMNANPSR1PTPN1GABRA1GABRB2
SCHEMBL1955058 0.82 LMNA (0.44) LMNANPSR1PTPN1GABRA1GABRB2
SCHEMBL5590843 0.79 NPSR1 (0.47) LMNANPSR1PTPN1ALDH1A1TP53
SCHEMBL30172661 0.79 PTPN1 (0.43) LMNANPSR1PTPN1GABRA1GABRB2
SCHEMBL4974968 0.79 PTPN1 (0.43) LMNANPSR1PTPN1GABRA1GABRB2

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
WO-2000004775-A1 MOLLUSCICIDAL COMPOSITION UNIVERSITY COLLEGE CARDIFF CONSULTANTS LIMITED (GB) 2000-02-03 WO claimed
EP-2585073-B1 ANTIVIRAL COMPOUNDS PROSETTA ANTIVIRAL INC (US) 2016-04-27 EP disclosed
US-8785434-B2 Antiviral compounds PROSETTA ANTIVIRAL INC. (US) 2014-07-22 US disclosed
US-8759336-B2 Antiviral compounds PROSETTA ANTIVIRAL INC. (US) 2014-06-24 US disclosed
EP-2585073-A1 ANTIVIRAL COMPOUNDS Prostetta Antiviral Inc. (US) 2013-05-01 EP disclosed
EP-2550261-A2 PYRIDAZINE COMPOUNDS FOR CONTROLLING INVERTEBRATE PESTS BASF SE (DE) 2013-01-30 EP disclosed
WO-2012125983-A1 ANTIVIRAL TREATMENTS PROSETTA ANTIVIRAL INC. (US) 2012-09-20 WO disclosed
US-20120238543-A1 Antiviral Compounds Prosetta Antiviral, Inc. (US) 2012-09-20 US disclosed
US-20120157435-A1 Antiviral Compounds PROSETTA ANTIVIRAL INC. (US) 2012-06-21 US disclosed
WO-2011137447-A1 ANTIVIRAL COMPOUNDS PROSTETTA ANTIVIRAL INC. (US) 2011-11-03 WO disclosed
WO-2011117213-A1 PYRIDAZINE COMPOUNDS FOR CONTROLLING INVERTEBRATE PESTS BASF SE (DE) 2011-09-29 WO disclosed
WO-2011117806-A2 PYRIDAZINE COMPOUNDS FOR CONTROLLING INVERTEBRATE PESTS BASF SE (DE) 2011-09-29 WO disclosed
WO-2000004775-A1 MOLLUSCICIDAL COMPOSITION UNIVERSITY COLLEGE CARDIFF CONSULTANTS LIMITED (GB) 2000-02-03 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 (2 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-20120238543-A1 Antiviral Compounds MAVS, EIF2AK2, IRF3 LMNA 3112/4885NPSR1 3707/4885PTPN1 2319/4885
US-20120157435-A1 Antiviral Compounds MAVS, ZC3HAV1, EIF2AK2 LMNA 1442/4885NPSR1 3601/4885PTPN1 3428/4885

“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.