SCHEMBL2111908

SCHEMBL2111908

CC(C)(C)C(Oc1ccc(Cl)cc1-c1cccc2cccnc12)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.42
MEN1 O00255 4/20 0.42
L3MBTL1 Q9Y468 3/20 0.42
LMNA P02545 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
GAA P10253 2/20 0.42
EIF4EBP1 Q13541 1/20 0.41
KDR P35968 2/20 0.40
PTGER1 P34995 4/20 0.39
SERPINE1 P05121 1/20 0.39
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
HTT P42858 1/20 0.38
PPARG P37231 2/20 0.38
TSHR P16473 1/20 0.38
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
HTR2B P41595 1/20 0.38
RAB9A P51151 2/20 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
SCHEMBL1753409 0.78 PTGDR2 (0.59) L3MBTL1LMNASMN1; SMN2GAAEIF4EBP1
SCHEMBL2112216 0.73 CTSA (0.39) PPARGTSHRHTR2AHTR2CHTR2B
SCHEMBL1368034 0.72 PTGDR2 (0.65)
SCHEMBL1369990 0.70 PPARA (0.54) KMT2AMEN1LMNASMN1; SMN2GAA
SCHEMBL2104209 0.70 TSHR (0.46) KMT2AMEN1LMNASMN1; SMN2GAA
SCHEMBL2111718 0.68 AOC3 (0.45) KMT2AMEN1L3MBTL1LMNASMN1; SMN2
Mecoprop SCHEMBL9429308 0.68 TSHR (0.64) KMT2AMEN1L3MBTL1LMNASMN1; SMN2
SCHEMBL1368429 0.67 TSHR (0.43) KMT2AMEN1MAPTPPARGTSHR
SCHEMBL18434779 0.67 CRHR1 (0.54) KMT2AMEN1L3MBTL1LMNASMN1; SMN2
SCHEMBL4624746 0.67 KDM4E (0.36) KMT2AMEN1L3MBTL1ALDH1A1MAPT

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-8158820-B2 Compounds ASTRAZENECA AB (SE) 2012-04-17 US disclosed
US-20060264435-A1 Novel compounds ASTRAZENECA AB (SE) 2006-11-23 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-20060264435-A1 Novel compounds ADRA2C, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, HCAR2 KMT2A 1676/4885MEN1 3390/4885L3MBTL1 4834/4885

“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.