SCHEMBL21472087

SCHEMBL21472087

COCCCCCN1CCCCC1

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 14/20 0.65
MEN1 O00255 1/20 0.49
ALDH1A1 P00352 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP2D6 P10635 1/20 0.49
KMT2A Q03164 1/20 0.49
KCNH2 Q12809 1/20 0.47
HRH4 Q9H3N8 1/20 0.47

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
SCHEMBL10103385 0.98 HRH3 (0.61) HRH3MEN1ALDH1A1CYP1A2CYP2D6
SCHEMBL13849154 0.98 HRH3 (0.61) HRH3MEN1ALDH1A1CYP1A2CYP2D6
SCHEMBL10103384 0.96 HRH3 (0.56) HRH3MEN1ALDH1A1CYP1A2CYP2D6
SCHEMBL96486 0.91 HRH3 (0.56) HRH3ALDH1A1CYP2D6KCNH2
SCHEMBL2331849 0.91 HRH3 (0.56) HRH3ALDH1A1CYP2D6KCNH2
SCHEMBL25009132 0.90 HRH3 (0.58) HRH3MEN1ALDH1A1CYP1A2CYP2D6
SCHEMBL20325116 0.90 HRH3 (0.52) HRH3KCNH2
SCHEMBL11570576 0.89 HRH3 (0.46) HRH3ALDH1A1
SCHEMBL1277016 0.89 HRH3 (0.52) HRH3MEN1ALDH1A1CYP1A2CYP2D6
SCHEMBL10927336 0.89 HRH3 (0.46) HRH3ALDH1A1

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-11161841-B2 Modulators of proteolysis and associated methods of use ARVINAS OPERATIONS, INC. (US) 2021-11-02 US disclosed
US-20190315732-A1 MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. 2019-10-17 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 (2 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-20190315732-A1 MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE MDM2, CRBN, VHL HRH3 4061/4885MEN1 2058/4885ALDH1A1 2958/4885
US-11161841-B2 Modulators of proteolysis and associated methods of use MDM2, CRBN, VHL HRH3 4061/4885MEN1 2058/4885ALDH1A1 2958/4885

“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.