SCHEMBL17138186

SCHEMBL17138186

CC(C)/C=C/C(=O)Oc1cccc(OC(=O)/C=C/C(C)C)c1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.47
MEN1 O00255 3/20 0.47
HTR1A P08908 1/20 0.42
LMNA P02545 2/20 0.42
CYP3A4 P08684 1/20 0.42
ACHE P22303 2/20 0.41
MTNR1A P48039 6/20 0.40
MTNR1B P49286 6/20 0.40
NPC1 O15118 1/20 0.39
POLB P06746 1/20 0.39
BLM P54132 1/20 0.39
MCL1 Q07820 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
KDM4E B2RXH2 1/20 0.39
GAA P10253 1/20 0.39

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
SCHEMBL17138188 1.00 KMT2A (0.47) KMT2AMEN1HTR1ALMNACYP3A4
SCHEMBL1877111 0.87 HTR1A (0.50) KMT2AMEN1HTR1ALMNAL3MBTL1
SCHEMBL27694618 0.77 CYP1A2 (0.47) KMT2ALMNANPC1KDM4EGAA
SCHEMBL17138182 0.77 KMT2A (0.50) KMT2AMEN1HTR1ALMNACYP3A4
SCHEMBL17138180 0.77 KMT2A (0.50) KMT2AMEN1HTR1ALMNACYP3A4
SCHEMBL28972565 0.76 MTNR1A (0.55) KMT2AMEN1HTR1ALMNAMTNR1A
SCHEMBL17275582 0.76 SLC6A4 (0.38) KMT2AMEN1LMNANPC1POLB
SCHEMBL17138147 0.74 KMT2A (0.47) KMT2AMEN1HTR1ALMNACYP3A4
SCHEMBL17138213 0.74 KMT2A (0.47) KMT2AMEN1HTR1ALMNACYP3A4
SCHEMBL17138211 0.74 KMT2A (0.47) KMT2AMEN1HTR1ALMNACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150283051-A1 DERIVATIVE OF NOVEL POLYHYDROXY AROMATIC COMPOUND AND USE THEREOF RNS CO.,LTD. (KR) 2015-10-08 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-20150283051-A1 DERIVATIVE OF NOVEL POLYHYDROXY AROMATIC COMPOUND AND USE THEREOF HRH3, CBR3, H1-0 KMT2A 580/4885MEN1 4684/4885HTR1A 875/4885

“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.