SCHEMBL17124205

SCHEMBL17124205

COB(O)c1cccc(NC=O)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
NLRP3 Q96P20 1/20 0.38
RAB9A P51151 5/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
MAPT P10636 3/20 0.35
NFKB1 P19838 3/20 0.35
NFKB2 Q00653 3/20 0.35
RELA Q04206 3/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
KDM4E B2RXH2 1/20 0.35
HPGD P15428 1/20 0.35
KDR P35968 2/20 0.35
ENPP2 Q13822 1/20 0.35
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA4 P22748 1/20 0.34
NPC1 O15118 4/20 0.33
HTT P42858 1/20 0.33
TRPV1 Q8NER1 1/20 0.33

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
SCHEMBL1347461 0.81 ALDH1A1 (0.48) ALDH1A1NLRP3KDM4EENPP2TRPV1
SCHEMBL9893797 0.80 ALDH1A1 (0.35) ALDH1A1NLRP3
SCHEMBL12129057 0.72 ALDH1A1 (0.67) ALDH1A1MEN1KMT2AMAPTNFKB1
SCHEMBL21439215 0.72 HDAC3 (0.46) ALDH1A1NLRP3CA1CA2
SCHEMBL20273151 0.71 ENPP2 (0.59) ALDH1A1NLRP3KDM4EENPP2CA1
SCHEMBL1188678 0.70 ALDH1A1 (0.56) ALDH1A1NLRP3RAB9AMEN1KMT2A
SCHEMBL29959920 0.70 ALDH1A1 (0.56) ALDH1A1NLRP3RAB9AMEN1KMT2A
SCHEMBL2445253 0.70 RAB9A (0.59) ALDH1A1RAB9AMEN1KMT2AMAPT
SCHEMBL29281753 0.70 ALDH1A1 (0.44) ALDH1A1RAB9AMEN1KMT2AMAPT
SCHEMBL8297905 0.70 ACHE (0.44) ALDH1A1RAB9ANFKB1NFKB2RELA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9475802-B2 Inhibitors of viral replication, their process of preparation and their therapeutical uses LABORATOIRE BIODIM (FR) 2016-10-25 US disclosed
US-20150274718-A1 Inhibitors of Viral Replication, Their Process of Preparation and Their Therapeutical Uses LABORATOIRE BIODIM (FR) 2015-10-01 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 (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-20150274718-A1 Inhibitors of Viral Replication, Their Process of Preparation and Their Therapeutical Uses RPL35, EIF2AK2, MAVS ALDH1A1 3509/4885NLRP3 2503/4885RAB9A 1127/4885

“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.