SCHEMBL7657358

SCHEMBL7657358

O=C(OCc1ccccc1)c1ccc(Oc2nc(F)c(F)c(Oc3ccc([N+](=O)[O-])c(OCc4ccccc4)c3)c2F)cc1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.42
RAB9A P51151 2/20 0.42
MEN1 O00255 2/20 0.42
NPC1 O15118 1/20 0.42
ATM Q13315 1/20 0.42
MAPT P10636 6/20 0.40
ALDH1A1 P00352 2/20 0.40
MYC P01106 2/20 0.39
MAX P61244 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
CTSV O60911 2/20 0.37
CTSL P07711 2/20 0.37
LMNA P02545 1/20 0.36
MITF O75030 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A3 Q01959 1/20 0.36
TDP1 Q9NUW8 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
SCHEMBL7794998 0.90 MEN1 (0.47) KMT2ARAB9AMEN1NPC1ATM
SCHEMBL7652479 0.88 MAPT (0.43) KMT2ARAB9AMEN1NPC1ATM
SCHEMBL7654964 0.85 MAPT (0.49) KMT2ARAB9AMEN1NPC1ATM
SCHEMBL7651791 0.83 MAPT (0.40) KMT2ARAB9AMEN1NPC1ATM
SCHEMBL7794369 0.80 LMNA (0.41) KMT2ARAB9AMEN1NPC1ATM
SCHEMBL7152823 0.78 MAPT (0.43) KMT2ARAB9AMEN1NPC1ATM
SCHEMBL7154482 0.78 KMT2A (0.42) KMT2ARAB9AMEN1NPC1ATM
SCHEMBL7795531 0.77 CTSV (0.43) KMT2ARAB9AMEN1NPC1ATM
SCHEMBL4623468 0.77 MEN1 (0.45) KMT2ARAB9AMEN1NPC1ATM
SCHEMBL7653835 0.77 KMT2A (0.52) KMT2ARAB9AMEN1NPC1MAPT

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
US-6437178-B2 REACTING A HALOGENATED BENZENE COMPOUND WITH NITRO(THIO)PHENOL; REDUCTION INFINEON TECHNOLOGIES AG (DE) 2002-08-20 US disclosed
US-20010056203-A1 O-aminophenolcarboxylic acid and o-aminothiophenolcarboxylic acid SIEMENS AKTIENGESELLSCHAFT 2001-12-27 US disclosed
EP-0905123-B1 o-amino(thio)phenol-carboxylic acids and their preparation INFINEON TECHNOLOGIES AG (DE) 2001-12-12 EP disclosed
US-6310238-B1 INTERMEDIATES FOR THE PREPARATION OF POLYBENZOXAZOLES AND POLYBENZOTHIAZOLES SIEMENS AKTIENGESELLSCHAFT (DE) 2001-10-30 US disclosed
EP-0905123-A1 o-amino(thio)phenol-carboxylic acids and their preparation SIEMENS AKTIENGESELLSCHAFT (DE) 1999-03-31 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-20010056203-A1 O-aminophenolcarboxylic acid and o-aminothiophenolcarboxylic acid TPMT, PAH, AADAT KMT2A 985/4885RAB9A 4769/4885MEN1 3676/4885

“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.