SCHEMBL12410885

SCHEMBL12410885

C=C(C)C(=O)OCCN(CCOC(=O)C(=C)C)CCN1C(=C)C(C)(C)c2ccccc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
BCHE P06276 1/20 0.34
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
TP53 P04637 3/20 0.33
LMNA P02545 3/20 0.33
THRB P10828 1/20 0.33
POLB P06746 4/20 0.33
KDM4E B2RXH2 3/20 0.32
HTT P42858 2/20 0.32
HSD17B10 Q99714 2/20 0.32
MAPT P10636 3/20 0.32
MAPK1 P28482 2/20 0.32
GPR55 Q9Y2T6 1/20 0.32
PRCP P42785 1/20 0.32
SIGMAR1 Q99720 1/20 0.32
ALDH1A1 P00352 1/20 0.31
MEN1 O00255 1/20 0.31

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
SCHEMBL9222528 0.89 OPRM1 (0.38) KMT2ACYP1A2CYP2D6CA1CA2
SCHEMBL9089556 0.84 POLB (0.42) KMT2ACYP1A2CYP2D6CA1CA2
SCHEMBL13619880 0.79 KMT2A (0.40) KMT2ACYP1A2CYP2D6TP53LMNA
SCHEMBL8942258 0.78 OPRM1 (0.47) KMT2ACYP1A2CYP2D6TP53LMNA
SCHEMBL14428162 0.75 KMT2A (0.39) KMT2ACYP1A2CYP2D6BCHETP53
SCHEMBL14582152 0.74 MAPT (0.48) KMT2ACYP1A2CYP2D6LMNATHRB
SCHEMBL4982011 0.70 KMT2A (0.44) KMT2ACYP1A2CYP2D6TP53LMNA
SCHEMBL31556453 0.70 THRB (0.43) CA1CA2THRBPOLBHTT
SCHEMBL2180470 0.70 KMT2A (0.46) KMT2ACYP1A2CYP2D6TP53LMNA
SCHEMBL13739549 0.70 MEN1 (0.40) KMT2ACYP1A2LMNAPOLBKDM4E

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-20110166297-A1 MOLECULARLY IMPRINTED SMART POLYMERS (MISPs) Sailo Nanotechnologies Ltd. (IL) 2011-07-07 US disclosed
US-20110166297-A1 MOLECULARLY IMPRINTED SMART POLYMERS (MISPs) Sailo Nanotechnologies Ltd. (IL) 2011-07-07 US disclosed
WO-2010029541-A1 MOLECULARLY IMPRINTED SMART POLYMERS (MISPs) SALIO NANOTECHNOLOGIES LTD. (IL) 2010-03-18 WO 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-20110166297-A1 MOLECULARLY IMPRINTED SMART POLYMERS (MISPs) MSI2, SLIRP, BRAP KMT2A 1647/4885CYP1A2 2832/4885CYP2D6 3823/4885

“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.