SCHEMBL20699461

SCHEMBL20699461

C#CCOCc1ccc2ccc3cccc4ccc1c2c34

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
GBA1 P04062 2/20 0.40
UGCG Q16739 2/20 0.40
GBA2 Q9HCG7 2/20 0.40
ALDH1A1 P00352 6/20 0.40
KDM4E B2RXH2 4/20 0.40
HPGD P15428 5/20 0.38
HSD17B10 Q99714 4/20 0.38
CYP3A4 P08684 2/20 0.38
TSHR P16473 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CYP1A1 P04798 2/20 0.37
CYP1B1 Q16678 2/20 0.37
CYP1A2 P05177 4/20 0.36
ERBB2 P04626 1/20 0.36
FYN P06241 1/20 0.36
MAOA P21397 1/20 0.36
ACHE P22303 1/20 0.36

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
SCHEMBL20699460 0.88 CYP1A1 (0.42) KMT2AMEN1GBA1UGCGGBA2
SCHEMBL901166 0.84 KMT2A (0.50) KMT2AMEN1GBA1UGCGGBA2
SCHEMBL1607476 0.81 MEN1 (0.50) KMT2AMEN1GBA1UGCGGBA2
SCHEMBL15082603 0.78 KMT2A (0.45) KMT2AMEN1GBA1UGCGGBA2
SCHEMBL7958968 0.78 CYP1A2 (0.44) KMT2AMEN1HPGDTDP1CYP1A2
SCHEMBL15583053 0.78 KMT2A (0.49) KMT2AMEN1GBA1UGCGGBA2
SCHEMBL9816053 0.75 GBA1 (0.46) KMT2AMEN1GBA1UGCGGBA2
SCHEMBL22876048 0.75 MTNR1A (0.40) MTNR1A
SCHEMBL15917128 0.75 KMT2A (0.53) KMT2AMEN1ALDH1A1KDM4EHPGD
SCHEMBL17513032 0.74 KMT2A (0.42) KMT2AMEN1GBA1UGCGGBA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10669250-B2 Hypervalent iodine CF2CF2X reagents and their use ETH ZURICH (CH) 2020-06-02 US disclosed
US-10669250-B2 Hypervalent iodine CF2CF2X reagents and their use ETH ZURICH (CH) 2020-06-02 US disclosed
US-20190040036-A1 HYPERVALENT IODINE CF2CF2X REAGENTS AND THEIR USE ETH ZURICH (CH) 2019-02-07 US disclosed
US-20190040036-A1 HYPERVALENT IODINE CF2CF2X REAGENTS AND THEIR USE ETH ZURICH (CH) 2019-02-07 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 (2 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-10669250-B2 Hypervalent iodine CF2CF2X reagents and their use TPO, FANCF, FANCI KMT2A 741/4885MEN1 220/4885GBA1 1034/4885
US-20190040036-A1 HYPERVALENT IODINE CF2CF2X REAGENTS AND THEIR USE TPO, FANCF, FANCI KMT2A 741/4885MEN1 220/4885GBA1 1034/4885

“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.