SCHEMBL3751900

SCHEMBL3751900

Oc1ccc(C=C(Br)Br)cc1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.46
HSD17B10 Q99714 3/20 0.46
BACE1 P56817 1/20 0.44
CA2 P00918 2/20 0.43
CA1 P00915 1/20 0.43
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
ESR2 Q92731 2/20 0.39
HDAC2 Q92769 1/20 0.39
SIRT1 Q96EB6 1/20 0.39
LMNA P02545 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
HPGD P15428 2/20 0.37
EGFR P00533 2/20 0.37
ALDH1A1 P00352 2/20 0.37
KDM4E B2RXH2 1/20 0.37
TP53 P04637 1/20 0.37
CYP1A2 P05177 1/20 0.37
ALPL P05186 1/20 0.37
CYP3A4 P08684 1/20 0.37

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
SCHEMBL3692880 0.81 TSHR (0.48) TSHRHSD17B10BACE1CA2CA1
SCHEMBL13082127 0.80 LCK (0.58) TSHRHSD17B10BACE1CA2CA1
SCHEMBL9622274 0.78 LCK (0.61) TSHRHSD17B10BACE1CA2CA1
SCHEMBL9622273 0.78 LCK (0.61) TSHRHSD17B10BACE1CA2CA1
SCHEMBL3757653 0.77 AMY1A (0.50) TSHRHSD17B10MEN1KMT2ASIRT1
SCHEMBL11001027 0.76 TSHR (0.52) TSHRHSD17B10BACE1CA2CA1
SCHEMBL3752323 0.75 TP53 (0.46) TSHRHSD17B10BACE1MEN1KMT2A
SCHEMBL115626 0.74 ALDH1A1 (0.64) TSHRHSD17B10BACE1CA2CA1
SCHEMBL29433282 0.74 ALDH1A1 (0.64) TSHRHSD17B10BACE1CA2CA1
SCHEMBL2879838 0.74 TRPA1 (0.52) TSHRHSD17B10BACE1CA2CA1

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 TSHR 4694/4885HSD17B10 1479/4885BACE1 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.