SCHEMBL4487538

SCHEMBL4487538

Cc1c(O)ccc2c3c(ccc12)C1(OC(=O)c2ccccc21)c1ccc(O)cc1O3

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FTO Q9C0B1 8/20 0.67
MAPT P10636 6/20 0.67
MEN1 O00255 5/20 0.67
KMT2A Q03164 5/20 0.67
TDP1 Q9NUW8 4/20 0.67
HTT P42858 2/20 0.67
HPGD P15428 2/20 0.67
CYP2C19 P33261 2/20 0.67
RECQL P46063 2/20 0.67
BLM P54132 2/20 0.67
PRMT1 Q99873 2/20 0.67
ACE2 Q9BYF1 2/20 0.67
SMAD3 P84022 1/20 0.67
LMNA P02545 5/20 0.57
POLB P06746 2/20 0.57
GPR55 Q9Y2T6 2/20 0.57
ALOX12 P18054 2/20 0.57
NPSR1 Q6W5P4 2/20 0.57
GNG2 P59768 1/20 0.54
GNB1 P62873 1/20 0.54

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
SCHEMBL8417826 0.91 FTO (0.73) FTOMAPTMEN1KMT2ATDP1
SCHEMBL5270629 0.84 FTO (0.73) FTOMAPTMEN1KMT2ATDP1
SCHEMBL29362878 0.84 FTO (0.73) FTOMAPTMEN1KMT2ATDP1
SCHEMBL31326016 0.84 FTO (0.76) FTOMAPTMEN1KMT2ATDP1
SCHEMBL5066567 0.83 FTO (0.74) FTOMAPTMEN1KMT2ATDP1
SCHEMBL5775292 0.83 FTO (0.70) FTOMAPTMEN1KMT2ATDP1
SCHEMBL31063767 0.82 FTO (0.73) FTOMAPTMEN1KMT2ATDP1
SCHEMBL5359408 0.82 FTO (0.73) FTOMAPTMEN1KMT2ATDP1
SCHEMBL20907331 0.82 FTO (0.73) FTOMAPTMEN1KMT2ATDP1
SCHEMBL3652107 0.82 FTO (0.73) FTOMAPTMEN1KMT2ATDP1

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-7488820-B2 Naphthofluorescein-based metal sensors, and methods of making and using the same MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2009-02-10 US disclosed
US-20050186555-A1 Naphthofluorescein-based metal sensors, and methods of making and using the same NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2005-08-25 US disclosed
WO-2005067580-A2 NAPHTHOFLUORESCEIN-BASED METAL SENSORS, AND METHODS OF MAKING AND USING THE SAME MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2005-07-28 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-20050186555-A1 Naphthofluorescein-based metal sensors, and methods of making and using the same NCF1, NDUFV2, NQO1 FTO 2074/4885MAPT 2751/4885MEN1 927/4885

“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.