SCHEMBL17208334

SCHEMBL17208334

O=C1C(Cl)=C(N2CCCCC2)C(=O)N1c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 8/20 1.00
▸ MAPT P10636 8/20 1.00
▸ ALDH1A1 P00352 7/20 1.00
▸ MAPK1 P28482 5/20 1.00
▸ ALOX15 P16050 4/20 1.00
▸ HSD17B10 Q99714 4/20 1.00
▸ HPGD P15428 3/20 1.00
▸ TSHR P16473 3/20 1.00
▸ TDP1 Q9NUW8 1/20 1.00
▸ POLB P06746 4/20 0.77
▸ MEN1 O00255 2/20 0.77
▸ KMT2A Q03164 2/20 0.77
▸ RAD51 Q06609 1/20 0.73
▸ SMN1; SMN2 Q16637 1/20 0.73
▸ CASP1 P29466 1/20 0.68
▸ NPSR1 Q6W5P4 1/20 0.68
▸ BCL2A1 Q16548 1/20 0.62
▸ LMNA P02545 1/20 0.60

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
SCHEMBL13186479 0.84 MAPT (1.00) L3MBTL1MAPTALDH1A1MAPK1ALOX15
SCHEMBL25244921 0.84 L3MBTL1 (0.78) L3MBTL1MAPTALDH1A1MAPK1ALOX15
SCHEMBL15347242 0.83 L3MBTL1 (0.97) L3MBTL1MAPTALDH1A1MAPK1ALOX15
SCHEMBL13912138 0.80 BCL2A1 (0.75) L3MBTL1MAPTALDH1A1MAPK1ALOX15
SCHEMBL5682657 0.79 L3MBTL1 (0.66) L3MBTL1MAPTALDH1A1MAPK1ALOX15
SCHEMBL13912151 0.78 BCL2A1 (0.77) L3MBTL1MAPTALDH1A1MAPK1ALOX15
SCHEMBL2488181 0.76 ALDH1A1 (0.59) L3MBTL1MAPTALDH1A1MAPK1ALOX15
SCHEMBL13186473 0.72 RAD51 (1.00) L3MBTL1MAPTALDH1A1MAPK1ALOX15
SCHEMBL13912142 0.72 BCL2A1 (1.00) L3MBTL1MAPTALDH1A1MAPK1ALOX15
SCHEMBL17208335 0.71 RAD51 (0.64) L3MBTL1MAPTALDH1A1MAPK1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150306069-A1 METHODS AND COMPOSITIONS INVOLVING RAD51 INHIBITORS THE UNIVERSITY OF CHICAGO (US) 2015-10-29 — — 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-20150306069-A1 METHODS AND COMPOSITIONS INVOLVING RAD51 INHIBITORS RAD51, MRE11, RAD50 L3MBTL1 1927/4885MAPT 2482/4885ALDH1A1 3973/4885

“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.

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