SCHEMBL9931971

SCHEMBL9931971

CCc1ccccc1N(C(C)=O)c1ccccc1C

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.50
NPSR1 Q6W5P4 2/20 0.44
CYP3A4 P08684 2/20 0.43
PTPN1 P18031 2/20 0.41
KMT2A Q03164 2/20 0.40
TRPM8 Q7Z2W7 1/20 0.40
ALDH1A1 P00352 3/20 0.39
TP53 P04637 2/20 0.39
MEN1 O00255 1/20 0.39
TSHR P16473 1/20 0.38
KDM4E B2RXH2 1/20 0.38
MAPT P10636 1/20 0.38
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL2372910 0.91 LMNA (0.56) LMNANPSR1PTPN1ALDH1A1TP53
SCHEMBL22917037 0.87 LMNA (0.53) LMNANPSR1CYP3A4KMT2ATRPM8
SCHEMBL7985518 0.81 LMNA (0.51) LMNANPSR1PTPN1KMT2AALDH1A1
SCHEMBL7985338 0.77 KMT2A (0.54) LMNANPSR1KMT2ATRPM8ALDH1A1
SCHEMBL12501297 0.76 LMNA (0.46) LMNANPSR1PTPN1ALDH1A1TP53
SCHEMBL7978939 0.74 LMNA (0.49) LMNANPSR1KMT2AALDH1A1TP53
SCHEMBL23031991 0.74 LMNA (0.49) LMNANPSR1CYP3A4KMT2ATRPM8
SCHEMBL21127506 0.74 ALDH1A1 (0.41) LMNACYP3A4KMT2ATRPM8ALDH1A1
SCHEMBL1955058 0.74 LMNA (0.44) LMNANPSR1PTPN1ALDH1A1MAPT
SCHEMBL8061230 0.74 LMNA (0.44) LMNANPSR1PTPN1ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2699241-B1 ANTIVIRAL COMPOUNDS PROSETTA ANTIVIRAL INC (US) 2016-07-27 EP disclosed
EP-2585073-B1 ANTIVIRAL COMPOUNDS PROSETTA ANTIVIRAL INC (US) 2016-04-27 EP disclosed
US-8828986-B2 Antiviral compounds PROSETTA ANTIVIRAL INC. (US) 2014-09-09 US disclosed
US-8785434-B2 Antiviral compounds PROSETTA ANTIVIRAL INC. (US) 2014-07-22 US disclosed
EP-2699241-A1 ANTIVIRAL COMPOUNDS Prosetta Antiviral Inc. (US) 2014-02-26 EP disclosed
WO-2012145567-A1 ANTIVIRAL COMPOUNDS PROSETTA ANTIVIRAL INC. (US) 2012-10-26 WO disclosed
US-20120270854-A1 Antiviral Compounds PROSETTA ANTIVIRAL INC. (US) 2012-10-25 US disclosed
US-20120157435-A1 Antiviral Compounds PROSETTA ANTIVIRAL INC. (US) 2012-06-21 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 (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-20120157435-A1 Antiviral Compounds MAVS, ZC3HAV1, EIF2AK2 LMNA 1442/4885NPSR1 3601/4885CYP3A4 2548/4885
US-20120270854-A1 Antiviral Compounds HAVCR2, MAVS, EIF2AK2 LMNA 966/4885NPSR1 3933/4885CYP3A4 2735/4885

“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.