SCHEMBL16632410

SCHEMBL16632410

O=c1ccn(CCBr)c(=O)[nH]1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.53
DUT P33316 11/20 0.51
CRBN Q96SW2 2/20 0.50
PKM P14618 1/20 0.49
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45

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
SCHEMBL24263706 0.89 DUT (0.55) L3MBTL1DUTCRBNPKM
SCHEMBL4348697 0.87 L3MBTL1 (0.59) L3MBTL1DUTCRBNPKMALDH1A1
SCHEMBL592080 0.87 DUT (0.55) L3MBTL1DUT
SCHEMBL7181572 0.85 DUT (0.54) L3MBTL1DUT
SCHEMBL8377765 0.83 PKM (0.51) L3MBTL1DUTCRBNPKMALDH1A1
SCHEMBL14861415 0.82 L3MBTL1 (0.54) L3MBTL1DUTCRBNPKMALDH1A1
SCHEMBL5024015 0.80 L3MBTL1 (0.53) L3MBTL1DUTCRBNPKMALDH1A1
SCHEMBL5024016 0.80 L3MBTL1 (0.53) L3MBTL1DUTCRBNPKMALDH1A1
SCHEMBL2983407 0.80 ALDH1A1 (0.57) L3MBTL1DUTCRBNPKMALDH1A1
SCHEMBL2990980 0.80 L3MBTL1 (0.53) L3MBTL1DUTCRBNPKMALDH1A1

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 879/4885DUT 19/4885CRBN 3954/4885

“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.