SCHEMBL16632282

SCHEMBL16632282

N#Cc1ccc2c(Oc3ccc(Cl)cc3OCCn3ccc(=O)[nH]c3=O)cccc2c1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.47
EIF4EBP1 Q13541 10/20 0.42
SLC6A4 P31645 1/20 0.35
ICMT O60725 2/20 0.35
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
MCL1 Q07820 3/20 0.34
BCL2L1 Q07817 2/20 0.34
BAD Q92934 1/20 0.34
MRGPRX4 Q96LA9 1/20 0.33
BCL2 P10415 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C19 P33261 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
SCHEMBL16632412 0.91 L3MBTL1 (0.49) L3MBTL1EIF4EBP1SLC6A4ICMTCYP1A2
SCHEMBL16632604 0.91 L3MBTL1 (0.42) L3MBTL1EIF4EBP1ICMTCA1CA2
SCHEMBL16634453 0.90 L3MBTL1 (0.39) L3MBTL1EIF4EBP1SLC6A4CA1CA2
SCHEMBL16644711 0.90 L3MBTL1 (0.39) L3MBTL1EIF4EBP1ICMTCYP2C19
SCHEMBL16632555 0.89 L3MBTL1 (0.47) L3MBTL1EIF4EBP1SLC6A4CYP1A2CYP2C19
SCHEMBL16632420 0.88 L3MBTL1 (0.47) L3MBTL1EIF4EBP1ICMTCA1CA2
SCHEMBL16632595 0.86 L3MBTL1 (0.44) L3MBTL1EIF4EBP1SLC6A4
SCHEMBL16632486 0.86 L3MBTL1 (0.53) L3MBTL1EIF4EBP1MCL1BCL2L1BAD
SCHEMBL16116697 0.85 L3MBTL1 (0.53) L3MBTL1EIF4EBP1SLC6A4ICMTMRGPRX4
SCHEMBL14871830 0.85 L3MBTL1 (0.53) L3MBTL1EIF4EBP1SLC6A4ICMTMRGPRX4

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-9382245-B2 Compounds and methods for treating HIV infections YALE UNIVERSITY (US) 2016-07-05 US disclosed
US-20150105351-A1 COMPOUNDS AND METHODS FOR TREATING HIV INFECTIONS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-04-16 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-20150105351-A1 COMPOUNDS AND METHODS FOR TREATING HIV INFECTIONS POLM, POLRMT, DHFR L3MBTL1 879/4885EIF4EBP1 4140/4885SLC6A4 4266/4885

“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.