SCHEMBL15868697

SCHEMBL15868697

Nc1nc(OCC(F)(F)F)nc(OCC(F)(F)F)n1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
CYP1A2 P05177 3/20 0.49
CYP2C19 P33261 3/20 0.49
LMNA P02545 3/20 0.42
TSHR P16473 1/20 0.42
ALDH1A1 P00352 3/20 0.42
MAPT P10636 2/20 0.42
KDM4E B2RXH2 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
HSP90AA1 P07900 2/20 0.42
HSP90AB1 P08238 2/20 0.42
USP2 O75604 1/20 0.42
THRB P10828 1/20 0.42
G6PD P11413 1/20 0.42
ALOX15 P16050 1/20 0.42
CASP1 P29466 1/20 0.42
HSD17B10 Q99714 1/20 0.42
TDP1 Q9NUW8 1/20 0.39
AMD1 P17707 1/20 0.35

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
SCHEMBL15870556 0.92 MEN1 (0.44) MEN1KMT2ACYP1A2CYP2C19LMNA
SCHEMBL15868231 0.90 MEN1 (0.46) MEN1KMT2ACYP1A2CYP2C19LMNA
SCHEMBL10729628 0.90 MEN1 (0.46) MEN1KMT2ACYP1A2CYP2C19LMNA
SCHEMBL28867958 0.88 MEN1 (0.57) MEN1KMT2ACYP1A2CYP2C19LMNA
SCHEMBL10362552 0.83 MEN1 (0.56) MEN1KMT2ACYP1A2CYP2C19LMNA
SCHEMBL31079497 0.82 MEN1 (0.40) MEN1KMT2ACYP1A2CYP2C19LMNA
SCHEMBL7452356 0.82 MEN1 (0.40) MEN1KMT2ACYP1A2CYP2C19LMNA
SCHEMBL28230170 0.79 KDM4E (0.41) MEN1KMT2ACYP1A2CYP2C19LMNA
SCHEMBL13728339 0.78 ADORA2A (0.53) MEN1KMT2ALMNATSHRALDH1A1
SCHEMBL25012029 0.77 MEN1 (0.49) MEN1KMT2ACYP1A2CYP2C19LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108970425-A A kind of high-salt wastewater processing polymer film and preparation method thereof 师帅帅 2018-12-11 CN claimed
CN-108034323-A A kind of environment-friendly interior wall coating and preparation method thereof 山东冬瑞高新技术开发有限公司 2018-05-15 CN claimed
CN-108970425-A A kind of high-salt wastewater processing polymer film and preparation method thereof 师帅帅 2018-12-11 CN disclosed
CN-108365038-A A kind of solar cell backboard film and preparation method thereof 湖南辰砾新材料有限公司 2018-08-03 CN disclosed
US-20140194429-A1 COMPOSITIONS FOR TREATMENT OF CANCER NOVARX CORPORATION 2014-07-10 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-20140194429-A1 COMPOSITIONS FOR TREATMENT OF CANCER TP53, MCL1, CD44 MEN1 3366/4885KMT2A 3142/4885CYP1A2 2968/4885

“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.