SCHEMBL12372939

SCHEMBL12372939

COCCCCCOc1ccc(C(C)(C)C)cc1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 5/20 0.58
KDM4E B2RXH2 4/20 0.51
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
POLB P06746 3/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
LMNA P02545 2/20 0.48
ALDH1A1 P00352 2/20 0.48
APP P05067 1/20 0.46
RAB9A P51151 3/20 0.45
NPC1 O15118 2/20 0.45
MITF O75030 2/20 0.45
CASP3 P42574 1/20 0.45
SENP7 Q9BQF6 1/20 0.45
TP53 P04637 1/20 0.45
GAA P10253 1/20 0.44

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
SCHEMBL10202420 0.98 HRH3 (0.55) HRH3KDM4EMEN1KMT2APOLB
SCHEMBL12238264 0.94 HRH3 (0.54) HRH3KDM4EMEN1KMT2APOLB
SCHEMBL21900557 0.93 HRH3 (0.51) HRH3KDM4EMEN1KMT2APOLB
SCHEMBL22248703 0.92 HRH3 (0.65) HRH3KDM4EMEN1KMT2APOLB
SCHEMBL22248702 0.90 HRH3 (0.62) HRH3KDM4EMEN1KMT2APOLB
SCHEMBL14369400 0.89 KDM4E (0.48) HRH3KDM4EMEN1KMT2ASMN1; SMN2
SCHEMBL1535647 0.88 KDM4E (0.54) HRH3KDM4EMEN1KMT2APOLB
SCHEMBL20234326 0.86 HRH3 (0.61) HRH3KDM4EMEN1KMT2APOLB
SCHEMBL23266158 0.85 NR5A1 (0.61) HRH3KDM4ELMNARAB9ANPC1
SCHEMBL12762363 0.85 NR5A1 (0.61) HRH3KDM4ELMNARAB9ANPC1

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-20110207741-A1 Activation of the Renin-Angiotensin System (RAS) and Sudden Cardiac Death THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2011-08-25 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-20110207741-A1 Activation of the Renin-Angiotensin System (RAS) and Sudden Cardiac Death GJA1, RASGRP1, RASGRP3 HRH3 3104/4885KDM4E 3435/4885MEN1 4242/4885

“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.