SCHEMBL16807286

SCHEMBL16807286

COc1ccc(C(C(=O)c2ccccc2)c2ccc(C)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.60
TDP1 Q9NUW8 3/20 0.58
L3MBTL1 Q9Y468 2/20 0.58
NPC1 O15118 3/20 0.54
MAPT P10636 3/20 0.54
RAB9A P51151 3/20 0.54
ALDH1A1 P00352 3/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
LMNA P02545 1/20 0.54
POLB P06746 1/20 0.54
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
CES2 O00748 1/20 0.53
CES1 P23141 1/20 0.53
PAX8 Q06710 1/20 0.52
HTT P42858 1/20 0.48
HSD17B10 Q99714 1/20 0.48
CNR1 P21554 1/20 0.48
CNR2 P34972 1/20 0.48
ACP3 P15309 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
SCHEMBL2921669 0.94 L3MBTL1 (0.66) NPSR1TDP1L3MBTL1NPC1MAPT
SCHEMBL2922278 0.92 L3MBTL1 (0.69) NPSR1TDP1L3MBTL1NPC1MAPT
SCHEMBL16781997 0.88 L3MBTL1 (0.73) NPSR1TDP1L3MBTL1NPC1MAPT
SCHEMBL7560417 0.87 L3MBTL1 (0.66) NPSR1TDP1L3MBTL1NPC1MAPT
SCHEMBL2928039 0.87 L3MBTL1 (0.77) NPSR1TDP1L3MBTL1NPC1MAPT
SCHEMBL27890551 0.82 L3MBTL1 (0.63) TDP1L3MBTL1NPC1MAPTRAB9A
SCHEMBL16807279 0.82 HPGD (0.57) NPSR1TDP1L3MBTL1NPC1MAPT
SCHEMBL15105761 0.81 L3MBTL1 (0.73) NPSR1TDP1L3MBTL1NPC1RAB9A
SCHEMBL16807289 0.81 TDP1 (0.61) TDP1L3MBTL1NPC1RAB9AALDH1A1
SCHEMBL16807277 0.81 L3MBTL1 (0.61) NPSR1TDP1L3MBTL1NPC1MAPT

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 NPSR1 3703/4885TDP1 4876/4885L3MBTL1 4386/4885

“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.