SCHEMBL3752323

SCHEMBL3752323

Cc1cc(C=C(Br)Br)ccc1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.46
TDP1 Q9NUW8 1/20 0.46
BACE1 P56817 1/20 0.44
PDE10A Q9Y233 1/20 0.43
ESR1 P03372 9/20 0.42
ESR2 Q92731 7/20 0.42
AR P10275 4/20 0.39
SIRT1 Q96EB6 1/20 0.39
ALOX5 P09917 1/20 0.38
PTGS1 P23219 1/20 0.38
PTGS2 P35354 1/20 0.38
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
CYP1A2 P05177 2/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2D6 P10635 2/20 0.38
MAPT P10636 2/20 0.38
CYP2C9 P11712 2/20 0.38
HPGD P15428 2/20 0.38
ALOX15 P16050 2/20 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
SCHEMBL16289927 0.83 TUBB1 (0.42) TDP1ALOX5PTGS1PTGS2KDM4E
SCHEMBL171048 0.81 TP53 (0.48) TP53TDP1BACE1PDE10AESR1
SCHEMBL13082127 0.80 LCK (0.58) TP53TDP1BACE1ALOX5PTGS2
SCHEMBL3747477 0.79 TP53 (0.46) TP53TDP1BACE1PDE10AESR1
SCHEMBL1824384 0.78 LCK (0.61) TP53TDP1BACE1PDE10AESR1
SCHEMBL1824386 0.78 LCK (0.61) TP53TDP1BACE1PDE10AESR1
SCHEMBL9845688 0.78 TP53 (0.45) TP53TDP1BACE1PDE10AESR1
SCHEMBL9845691 0.78 TP53 (0.45) TP53TDP1BACE1PDE10AESR1
SCHEMBL171076 0.77 AKR1C3 (0.53) TP53TDP1BACE1PDE10AESR1
SCHEMBL3757653 0.77 AMY1A (0.50) TP53SIRT1KDM4EALDH1A1CYP1A2

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
CN-101888993-B Methoxyimino compounds and fungicide composition comprising same KYUNG NONG CORP 2013-08-21 CN disclosed
US-8410302-B2 Methoxyimino compounds and fungicide composition comprising same KYUNG NONG CORPORATION (KR) 2013-04-02 US disclosed
US-20100298593-A1 METHOXYIMINO COMPOUNDS AND FUNGICIDE COMPOSITION COMPRISING SAME KYUNG NONG CORPORATION (KR) 2010-11-25 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-20100298593-A1 METHOXYIMINO COMPOUNDS AND FUNGICIDE COMPOSITION COMPRISING SAME CYP51A1, MSMO1, MTMR1 TP53 3913/4885TDP1 1966/4885BACE1 2115/4885

“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.