SCHEMBL16807285

SCHEMBL16807285

Cc1cc(C)cc(C(C(=O)c2ccccc2)c2ccccc2F)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.46
TDP1 Q9NUW8 1/20 0.46
HDAC4 P56524 8/20 0.43
HIF1A Q16665 2/20 0.41
CES2 O00748 2/20 0.40
CES1 P23141 2/20 0.40
GAA P10253 1/20 0.39
HDAC3 O15379 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
HDAC9 Q9UKV0 1/20 0.39
HDAC5 Q9UQL6 1/20 0.39
NCOR2 Q9Y618 1/20 0.39
LMNA P02545 3/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
PTGS2 P35354 1/20 0.37
PTPN1 P18031 1/20 0.37
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL2927883 0.84 L3MBTL1 (0.66) L3MBTL1TDP1HDAC4HIF1ACES2
SCHEMBL2928276 0.82 TDP1 (0.55) L3MBTL1TDP1HDAC4HIF1ACES2
SCHEMBL16781991 0.81 L3MBTL1 (0.71) L3MBTL1TDP1HDAC4CES2CES1
SCHEMBL16807277 0.78 L3MBTL1 (0.61) L3MBTL1TDP1CES2CES1LMNA
SCHEMBL16781983 0.75 L3MBTL1 (0.56) L3MBTL1TDP1HDAC4CES2CES1
SCHEMBL6518924 0.73 PGR (0.47) L3MBTL1TDP1HIF1ACES2CES1
SCHEMBL9056471 0.73 CES2 (0.66) L3MBTL1TDP1CES2CES1LMNA
SCHEMBL16807280 0.72 L3MBTL1 (0.56) L3MBTL1TDP1CES2CES1GAA
SCHEMBL16807284 0.70 L3MBTL1 (0.69) L3MBTL1TDP1CES2CES1GAA
SCHEMBL11000200 0.69 CES2 (0.50) HDAC4HIF1ACES2CES1GAA

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 4876/4885HDAC4 2766/4885

“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.