SCHEMBL3757787

SCHEMBL3757787

CCCC(O)(CC)Nc1ccc(C)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.49
MAPT P10636 2/20 0.38
POLB P06746 3/20 0.37
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
NPSR1 Q6W5P4 2/20 0.36
HTT P42858 2/20 0.36
LMNA P02545 1/20 0.35
TDP1 Q9NUW8 3/20 0.35
HPGD P15428 2/20 0.34
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HSP90AA1 P07900 1/20 0.33
HSP90AB1 P08238 1/20 0.33
THRB P10828 1/20 0.33
ALOX15 P16050 1/20 0.33
MAPK1 P28482 1/20 0.33
CASP1 P29466 1/20 0.33
BLM P54132 1/20 0.33
PLEC Q15149 1/20 0.33

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
SCHEMBL13091135 0.75 GAA (0.45) GAAMAPTPOLBMEN1KMT2A
SCHEMBL1248173 0.71 TDP1 (0.44) GAAMAPTPOLBMEN1KMT2A
SCHEMBL21058261 0.70 MAPT (0.50) GAAMAPTPOLBMEN1KMT2A
SCHEMBL3757783 0.69 MAPT (0.50) GAAMAPTPOLBMEN1KMT2A
Ammonia Solution, Strong SCHEMBL9364517 0.68 MAPT (0.43) GAAMAPTPOLBMEN1KMT2A
SCHEMBL5983235 0.68 NPC1 (0.48) GAAMAPTPOLBMEN1KMT2A
SCHEMBL19130783 0.66 TSHR (0.48) GAAMAPTMEN1KMT2AALDH1A1
SCHEMBL15478310 0.66 TSHR (0.48) GAAMAPTMEN1KMT2AALDH1A1
SCHEMBL193237 0.64 MAPT (0.39) GAAMAPTPOLBNPSR1HTT
SCHEMBL1199683 0.64

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8455413-B2 Additive for oils and lubricant comprising the same KH NEOCHEM CO., LTD. (JP) 2013-06-04 US disclosed
US-20100298183-A1 ADDITIVE FOR OILS AND LUBRICANT COMPRISING THE SAME KYOWA HAKKO CHEMICAL CO., LTD. (JP) 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-20100298183-A1 ADDITIVE FOR OILS AND LUBRICANT COMPRISING THE SAME NCOA2, NCOR2, NR1H2 GAA 4788/4885MAPT 4173/4885POLB 1788/4885

“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.