SCHEMBL6869993

SCHEMBL6869993

CCOC(=O)/C(F)=C\c1ccc(-c2ncccn2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.47
MEN1 O00255 7/20 0.47
KMT2A Q03164 7/20 0.47
LMNA P02545 3/20 0.47
NPSR1 Q6W5P4 2/20 0.47
CYP1A2 P05177 2/20 0.47
CYP2C19 P33261 2/20 0.47
CYP2C9 P11712 1/20 0.47
MAPK1 P28482 2/20 0.43
S1PR4 O95977 1/20 0.43
S1PR1 P21453 1/20 0.43
KDM4E B2RXH2 5/20 0.42
ALDH1A1 P00352 5/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
NR1H4 Q96RI1 1/20 0.42
BACE1 P56817 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
MITF O75030 1/20 0.41
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 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
SCHEMBL6273411 1.00 MAPT (0.47) MAPTMEN1KMT2ALMNANPSR1
SCHEMBL6273413 1.00 MAPT (0.47) MAPTMEN1KMT2ALMNANPSR1
SCHEMBL7070799 0.83 MEN1 (0.59) MAPTMEN1KMT2ALMNANPSR1
SCHEMBL7070797 0.83 MEN1 (0.59) MAPTMEN1KMT2ALMNANPSR1
SCHEMBL30673552 0.80 MAPT (0.50) MAPTMEN1KMT2ALMNANPSR1
SCHEMBL11309469 0.79 MEN1 (0.72) MAPTMEN1KMT2ALMNANPSR1
SCHEMBL11309467 0.79 MEN1 (0.72) MAPTMEN1KMT2ALMNANPSR1
SCHEMBL10697747 0.79 MEN1 (0.72) MAPTMEN1KMT2ALMNANPSR1
SCHEMBL14705767 0.78 MAPT (0.55) MAPTMEN1KMT2ALMNANPSR1
SCHEMBL30673556 0.78 MEN1 (0.44) MAPTMEN1KMT2ALMNANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6825170-B2 ERYTHROMYCIN TYPE MACROLIDE WITH A FUSED OXAZOLONE RING ORTHO-MCNEIL PHARMACEUTICAL, INC. 2004-11-30 US disclosed
US-20030220272-A1 6-O-acyl ketolide antibacterials ORTHO-MCNEIL PHARMACEUTICAL, INC. 2003-11-27 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-20030220272-A1 6-O-acyl ketolide antibacterials Q6ZSR9, ACSL6, RPS4Y1 MAPT 4142/4885MEN1 4580/4885KMT2A 565/4885

“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.