SCHEMBL18910239

SCHEMBL18910239

CCC(Cc1ccc(C(=O)OC(C)C)cc1)(C(=O)c1ccc(N2CCOCC2)cc1)N(C)C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.44
MAPT P10636 3/20 0.44
LMNA P02545 3/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ALDH1A1 P00352 4/20 0.40
TDP1 Q9NUW8 2/20 0.40
MAPK1 P28482 1/20 0.40
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
CYP4F2 P78329 1/20 0.39
CYP4A11 Q02928 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALOX12 P18054 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
GSK3B P49841 1/20 0.38
NPC1 O15118 1/20 0.38
POLB P06746 1/20 0.37
CTDSP1 Q9GZU7 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
HDAC6 Q9UBN7 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
SCHEMBL18905143 0.90 MEN1 (0.41) L3MBTL1MAPTLMNASMN1; SMN2ALDH1A1
SCHEMBL8898680 0.90 MAPT (0.47) L3MBTL1MAPTLMNASMN1; SMN2ALDH1A1
SCHEMBL18910301 0.89 MRGPRX4 (0.46) L3MBTL1MAPTLMNASMN1; SMN2ALDH1A1
SCHEMBL1629303 0.89 MAPT (0.53) L3MBTL1MAPTLMNASMN1; SMN2ALDH1A1
SCHEMBL20097747 0.88 MEN1 (0.45) L3MBTL1MAPTLMNASMN1; SMN2ALDH1A1
SCHEMBL18905140 0.88 MEN1 (0.45) L3MBTL1MAPTLMNASMN1; SMN2ALDH1A1
SCHEMBL1629158 0.87 TSHR (0.43) L3MBTL1MAPTLMNASMN1; SMN2ALDH1A1
SCHEMBL1630676 0.87 ALDH1A1 (0.51) L3MBTL1MAPTLMNASMN1; SMN2ALDH1A1
SCHEMBL18905142 0.86 MEN1 (0.43) L3MBTL1MAPTLMNASMN1; SMN2ALDH1A1
SCHEMBL1630543 0.86 MAPT (0.52) L3MBTL1MAPTLMNASMN1; SMN2ALDH1A1

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-9957402-B2 Compound, active energy ray curable composition, cured article thereof, printing ink, and inkjet recording ink DIC CORPORATION (JP) 2018-05-01 US disclosed
US-20170152391-A1 COMPOUND, ACTIVE ENERGY RAY CURABLE COMPOSITION, CURED ARTICLE THEREOF, PRINTING INK, AND INKJET RECORDING INK DIC CORPORATION (JP) 2017-06-01 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-20170152391-A1 COMPOUND, ACTIVE ENERGY RAY CURABLE COMPOSITION, CURED ARTICLE THEREOF, PRINTING INK, AND INKJET RECORDING INK CCNT1, EIF4A1, MARK1 L3MBTL1 1010/4885MAPT 1180/4885LMNA 1590/4885

“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.