SCHEMBL2751024

SCHEMBL2751024

Cc1cccc(Oc2cccnn2)c1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
MAP4K4 O95819 1/20 0.46
ACHE P22303 1/20 0.46
GAA P10253 1/20 0.44
LMNA P02545 4/20 0.41
HTT P42858 3/20 0.41
NPSR1 Q6W5P4 1/20 0.41
LYN P07948 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
MRGPRX1 Q96LB2 1/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
GRM5 P41594 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
MAPT P10636 2/20 0.39
TTBK1 Q5TCY1 1/20 0.39
TTBK2 Q6IQ55 1/20 0.39
AR P10275 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
SCHEMBL2750461 0.80 KMT2A (0.64) ALDH1A1MAP4K4ACHEGAALMNA
SCHEMBL8507818 0.80 MAP4K4 (0.59) ALDH1A1MAP4K4ACHEGAALMNA
SCHEMBL10626187 0.79 RET (0.40) ALDH1A1LMNAHTTL3MBTL1TDP1
SCHEMBL27857359 0.79 CYP1A2 (0.49) MAP4K4LMNATDP1GRM5TTBK1
SCHEMBL2048722 0.77 BCAT2 (0.52) ALDH1A1MAP4K4HTTL3MBTL1TDP1
SCHEMBL30310050 0.77 BCAT2 (0.52) ALDH1A1MAP4K4HTTL3MBTL1TDP1
SCHEMBL30310049 0.77 BCAT2 (0.52) ALDH1A1MAP4K4HTTL3MBTL1TDP1
SCHEMBL8559018 0.77 LMNA (0.50) ALDH1A1MAP4K4ACHEGAALMNA
SCHEMBL4799571 0.77 MEN1 (0.38) LMNAL3MBTL1MEN1KMT2ASMN1; SMN2
SCHEMBL17077901 0.76 MEN1 (0.60) ALDH1A1HTTNPSR1L3MBTL1MEN1

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-8178540-B2 Pyrimidylmethyl-sulfonamide compounds BASF SE (DE) 2012-05-15 US disclosed
US-20100077512-A1 Pyridazin-4-ylmethyl-sulfonamides used as Fungicides and Against Arthropods BASF SE (DE) 2010-03-25 US disclosed
US-20100069243-A1 Pyrimidylmethyl-Sulfonamide Compounds BASF SE (DE) 2010-03-18 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 (2 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-20100069243-A1 Pyrimidylmethyl-Sulfonamide Compounds TPMT, NISCH, PPA1 ALDH1A1 1588/4885MAP4K4 1858/4885ACHE 1528/4885
US-20100077512-A1 Pyridazin-4-ylmethyl-sulfonamides used as Fungicides and Against Arthropods PIR, PRDX4, PRDX2 ALDH1A1 2607/4885MAP4K4 644/4885ACHE 312/4885

“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.