SCHEMBL2963639

SCHEMBL2963639

CNC(=O)c1ccc(Oc2ccc(Cl)cc2N)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.60
SMN1; SMN2 Q16637 3/20 0.60
HPGD P15428 2/20 0.60
CYP1A2 P05177 2/20 0.60
CYP2C9 P11712 2/20 0.60
CYP2C19 P33261 2/20 0.60
MEN1 O00255 2/20 0.60
KMT2A Q03164 2/20 0.60
KDM4E B2RXH2 1/20 0.60
ALDH1A1 P00352 1/20 0.60
CYP2D6 P10635 1/20 0.60
HTT P42858 2/20 0.57
TSHR P16473 1/20 0.57
CYP3A4 P08684 1/20 0.55
BRAF P15056 3/20 0.55
HDAC1 Q13547 3/20 0.55
MMP13 P45452 1/20 0.51
LMNA P02545 2/20 0.50
SLC6A2 P23975 3/20 0.49
SLC6A4 P31645 3/20 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
SCHEMBL2964396 0.84 MAPT (0.66) MAPTSMN1; SMN2HPGDCYP1A2CYP2C9
SCHEMBL2965308 0.83 MAPT (0.55) MAPTSMN1; SMN2HPGDCYP1A2CYP2C9
SCHEMBL2017431 0.82 HPGD (0.52) MAPTSMN1; SMN2HPGDCYP1A2CYP2C9
SCHEMBL2968600 0.79 PDE7A (0.62) MAPTSMN1; SMN2HPGDMEN1KMT2A
SCHEMBL32674568 0.78 MAPT (0.96) MAPTSMN1; SMN2HPGDCYP1A2CYP2C9
SCHEMBL7140487 0.78 MAPT (0.96) MAPTSMN1; SMN2HPGDCYP1A2CYP2C9
SCHEMBL2966329 0.78 KMT2A (0.60) MAPTSMN1; SMN2HPGDCYP1A2CYP2C9
SCHEMBL10154321 0.78 HPGD (0.53) SMN1; SMN2HPGDMEN1KMT2AHTT
SCHEMBL2968570 0.77 MAPT (0.58) MAPTSMN1; SMN2HPGDCYP1A2CYP2C9
SCHEMBL2961914 0.77 ALDH1A1 (0.56) MAPTSMN1; SMN2HPGDCYP1A2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8338605-B2 Anti-viral compounds ABBOTT LABORATORIES (US) 2012-12-25 US disclosed
US-20100256139-A1 Anti-Viral Compounds ABBOTT LABORATORIES (US) 2010-10-07 US disclosed
EP-1979349-B1 ANTI-VIRAL COMPOUNDS ABBOTT LAB (US) 2010-07-28 EP disclosed
US-7763731-B2 Anti-viral compounds ABBOTT LABORATORIES (US) 2010-07-27 US disclosed
EP-1979349-A2 ANTI-VIRAL COMPOUNDS Abbott Laboratories (US) 2008-10-15 EP disclosed
US-20070232645-A1 ANTI-VIRAL COMPOUNDS ABBVIE INC. 2007-10-04 US disclosed
WO-2007076035-A2 ANTI-VIRAL COMPOUNDS ABBOTT LABORATORIES (US) 2007-07-05 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-20070232645-A1 ANTI-VIRAL COMPOUNDS HAVCR2, MAVS, EIF2AK2 MAPT 1347/4885SMN1; SMN2 3135/4885HPGD 3704/4885
US-20100256139-A1 Anti-Viral Compounds HAVCR2, MAVS, EIF2AK2 MAPT 1347/4885SMN1; SMN2 3135/4885HPGD 3704/4885

“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.