SCHEMBL18214564

SCHEMBL18214564

OC1=C(c2ccccc2)Oc2ccccc2C1O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.57
MAOB P27338 1/20 0.57
GUSB P08236 3/20 0.41
NTSR1 P30989 1/20 0.40
GPR55 Q9Y2T6 1/20 0.40
MTNR1A P48039 1/20 0.39
CYP2C9 P11712 1/20 0.38
ATM Q13315 1/20 0.37
HDAC3 O15379 1/20 0.35
HDAC4 P56524 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC7 Q8WUI4 1/20 0.35
HDAC2 Q92769 1/20 0.35
HDAC10 Q969S8 1/20 0.35
HDAC11 Q96DB2 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
HDAC9 Q9UKV0 1/20 0.35
HDAC5 Q9UQL6 1/20 0.35
MEN1 O00255 5/20 0.33

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
SCHEMBL8375730 0.77 MAOA (0.65) MAOAMAOBGUSBCYP2C9ATM
Hydrochloric Acid SCHEMBL28094942 0.76 MAOA (0.49) MAOAMAOBGUSBNTSR1GPR55
SCHEMBL2721424 0.74 MAOA (0.74) MAOAMAOBGUSBCYP2C9ATM
SCHEMBL521775 0.74 MAOA (1.00) MAOAMAOBCYP2C9ATMHDAC3
SCHEMBL29419966 0.74 MAOA (1.00) MAOAMAOBCYP2C9ATMHDAC3
Hydrochloric Acid SCHEMBL28094614 0.73 MAOA (0.46) MAOAMAOBGUSBNTSR1GPR55
SCHEMBL28681589 0.72 MAOA (0.95) MAOAMAOBCYP2C9ATMHDAC3
SCHEMBL4923442 0.70 MAOA (0.66) MAOAMAOBGUSBCYP2C9ATM
SCHEMBL7189875 0.68 NTSR1 (0.40) MAOAMAOBNTSR1GPR55MTNR1A
SCHEMBL25424957 0.67 MAOA (0.68) MAOAMAOBGUSBCYP2C9ATM

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-20170224609-A1 Oxidation resistant dentifrice compositions ARVANITIDOU EVANGELIA S (US) 2017-08-10 US disclosed
US-20170224609-A1 Oxidation resistant dentifrice compositions ARVANITIDOU EVANGELIA S (US) 2017-08-10 US disclosed
EP-1838275-B1 OXIDATION RESISTANT DENTIFRICE COMPOSITIONS COLGATE PALMOLIVE CO (US) 2016-11-09 EP 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-20170224609-A1 Oxidation resistant dentifrice compositions DNMT1, DNMT3A, CAT MAOA 3592/4885MAOB 3569/4885GUSB 1105/4885

“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.