SCHEMBL5865254

SCHEMBL5865254

O=C(OC(=O)Oc1ccc(F)cc1)Oc1ccc(F)cc1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.44
ATM Q13315 1/20 0.44
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42
MEN1 O00255 2/20 0.42
ALDH1A1 P00352 3/20 0.40
FAAH O00519 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KDM4E B2RXH2 1/20 0.40
CYP1A2 P05177 1/20 0.40
HPGD P15428 1/20 0.40
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
NR4A2 P43354 1/20 0.39
ELANE P08246 1/20 0.38
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL57245 0.90 KMT2A (0.50) KMT2AATMCES2CES1MEN1
SCHEMBL28555175 0.82 KMT2A (0.52) KMT2AMEN1ALDH1A1SMN1; SMN2HPGD
SCHEMBL14424402 0.82 ALOX15 (0.50) KMT2AATMMEN1ALDH1A1FAAH
SCHEMBL3946410 0.82 ALDH1A1 (0.49) KMT2AATMMEN1ALDH1A1FAAH
SCHEMBL10709297 0.80 NFE2L2 (0.53) KMT2ACES2CES1MEN1ALDH1A1
Guanidine SCHEMBL27421363 0.80 KMT2A (0.45) KMT2AATMCES2CES1MEN1
SCHEMBL13246362 0.80 LMNA (0.57) KMT2AMEN1ALDH1A1SMN1; SMN2CYP1A2
SCHEMBL18671115 0.80 KMT2A (0.44) KMT2AATMCES2CES1MEN1
SCHEMBL10710114 0.79 KMT2A (0.46) KMT2AATMCES2CES1MEN1
SCHEMBL14389790 0.78 KMT2A (0.46) KMT2AATMCES2CES1ALDH1A1

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-7030138-B2 Benzamidine derivatives SANKYO COMPANY, LIMITED (JP) 2006-04-18 US disclosed
US-20040147555-A1 Benzamidine derivatives SANKYO COMPANY, LIMITED (JP) 2004-07-29 US disclosed
EP-1375482-A1 BENZAMIDINE DERIVATIVE Sankyo Company, Limited (JP) 2004-01-02 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-20040147555-A1 Benzamidine derivatives F9, F7, F2 KMT2A 2377/4885ATM 2218/4885CES2 1013/4885

“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.