SCHEMBL16807288

SCHEMBL16807288

O=C(c1ccccc1)C(c1ccccc1)c1ccc(Br)cc1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.77
TDP1 Q9NUW8 1/20 0.77
MEN1 O00255 2/20 0.60
KMT2A Q03164 2/20 0.60
PTPN1 P18031 1/20 0.55
S1PR3 Q99500 1/20 0.54
LMNA P02545 3/20 0.52
CES2 O00748 1/20 0.52
CES1 P23141 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.51
CNR1 P21554 3/20 0.51
CNR2 P34972 2/20 0.48
ALDH1A1 P00352 2/20 0.47
HDAC3 O15379 1/20 0.47
HDAC4 P56524 1/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC7 Q8WUI4 1/20 0.47
HDAC2 Q92769 1/20 0.47
HDAC10 Q969S8 1/20 0.47
HDAC11 Q96DB2 1/20 0.47

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
SCHEMBL2927912 0.88 L3MBTL1 (1.00) L3MBTL1TDP1PTPN1LMNACES2
SCHEMBL17583713 0.82 L3MBTL1 (0.80) L3MBTL1TDP1MEN1KMT2APTPN1
SCHEMBL16807278 0.82 L3MBTL1 (0.80) L3MBTL1TDP1MEN1KMT2APTPN1
SCHEMBL17583575 0.82 L3MBTL1 (0.80) L3MBTL1TDP1PTPN1LMNACES2
Biphenyl SCHEMBL28656314 0.82 L3MBTL1 (0.87) L3MBTL1TDP1PTPN1LMNACES2
SCHEMBL2842478 0.82 MEN1 (0.59) L3MBTL1TDP1MEN1KMT2AS1PR3
SCHEMBL16807287 0.81 L3MBTL1 (0.77) L3MBTL1TDP1PTPN1LMNACES2
SCHEMBL2928039 0.81 L3MBTL1 (0.77) L3MBTL1TDP1MEN1KMT2APTPN1
SCHEMBL6201027 0.81 MEN1 (0.51) L3MBTL1TDP1MEN1KMT2AS1PR3
SCHEMBL6202239 0.81 LMNA (0.74) L3MBTL1TDP1MEN1KMT2AS1PR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9656947-B2 Process for creating carbon-carbon bonds using carbonyl compounds CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S) (FR) 2017-05-23 US disclosed
US-9656947-B2 Process for creating carbon-carbon bonds using carbonyl compounds CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S) (FR) 2017-05-23 US disclosed
EP-2858966-B1 PROCESS FOR CREATING CARBON-CARBON BONDS USING CARBONYL COMPOUNDS CENTRE NAT RECH SCIENT (FR) 2016-08-10 EP disclosed
US-20150166464-A1 PROCESS FOR CREATING CARBON-CARBON BONDS USING CARBONYL COMPOUNDS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N. R.S.) (FR) 2015-06-18 US disclosed
US-20150166464-A1 PROCESS FOR CREATING CARBON-CARBON BONDS USING CARBONYL COMPOUNDS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N. R.S.) (FR) 2015-06-18 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-20150166464-A1 PROCESS FOR CREATING CARBON-CARBON BONDS USING CARBONYL COMPOUNDS CBR3, CBR1, CYP4F3 L3MBTL1 4386/4885TDP1 4876/4885MEN1 690/4885

“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.