SCHEMBL15080038

SCHEMBL15080038

Fc1ccc(OCCc2ccccc2Br)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C19 P33261 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
TAAR1 Q96RJ0 3/20 0.46
SIRT2 Q8IXJ6 1/20 0.45
RAB9A P51151 3/20 0.44
NPC1 O15118 2/20 0.44
FFAR1 O14842 1/20 0.43
FFAR4 Q5NUL3 1/20 0.43
PARP10 Q53GL7 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
DRD2 P14416 3/20 0.40
DRD3 P35462 3/20 0.40
HTR1A P08908 1/20 0.40
HTR2A P28223 1/20 0.40
HRH1 P35367 1/20 0.40
TMEM97 Q5BJF2 1/20 0.40

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
SCHEMBL6870366 0.87 KCNA3 (0.52) TAAR1SIRT2RAB9ANPC1FFAR1
SCHEMBL2292141 0.84 PARP10 (0.59) RAB9ANPC1FFAR1FFAR4PARP10
SCHEMBL15079868 0.83 CYP1A2 (0.53) CYP1A2CYP2D6CYP2C19TDP1L3MBTL1
SCHEMBL15079870 0.80 CYP1A2 (0.50) CYP1A2CYP2D6CYP2C19TDP1L3MBTL1
SCHEMBL9854722 0.79 MPO (0.51) CYP1A2CYP2D6CYP2C19TDP1L3MBTL1
SCHEMBL20360954 0.79 MAOB (0.47) TAAR1SIRT2RAB9ANPC1PARP10
SCHEMBL15079866 0.79 L3MBTL1 (0.53) CYP1A2CYP2D6CYP2C19TDP1L3MBTL1
SCHEMBL14328006 0.78 DRD2 (0.52) MEN1KMT2ADRD2DRD3DRD4
SCHEMBL9854751 0.77 L3MBTL1 (0.51) CYP1A2CYP2D6CYP2C19TDP1L3MBTL1
SCHEMBL15079979 0.77 L3MBTL1 (0.56) CYP1A2CYP2D6CYP2C19TDP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150004110-A1 NOVEL ANTI-AGING AND DEPIGMENTING COSMETIC COMPOSITIONS DIVERCHIM (FR) 2015-01-01 US disclosed
US-20150004110-A1 NOVEL ANTI-AGING AND DEPIGMENTING COSMETIC COMPOSITIONS DIVERCHIM (FR) 2015-01-01 US disclosed
WO-2013093320-A1 NOVEL ANTI-AGING AND DEPIGMENTING COSMETIC COMPOSITIONS DIVERCHIM (FR) 2013-06-27 WO 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-20150004110-A1 NOVEL ANTI-AGING AND DEPIGMENTING COSMETIC COMPOSITIONS ARG1, TYR, NOS1 CYP1A2 828/4885CYP2D6 2905/4885CYP2C19 2737/4885

“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.