SCHEMBL16407191

SCHEMBL16407191

Clc1ccc(C(Nc2ccnc3cc(Cl)ccc23)c2ccc(CN3CCN(c4ccnc(N5CCCCC5)n4)CC3)cc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 8/20 0.44
APP P05067 2/20 0.43
BACE1 P56817 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
ACHE P22303 1/20 0.42
CASP1 P29466 1/20 0.42
CASP4 P49662 1/20 0.42
CASP5 P51878 1/20 0.42

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
SCHEMBL18500833 0.94 HRH3 (0.42) HRH3APPBACE1ACHE
SCHEMBL16407193 0.94 CYP3A4 (0.42) HRH3APPBACE1ACHECASP1
SCHEMBL16407040 0.93 RAD52 (0.47) HRH3APPMEN1KMT2AACHE
SCHEMBL16407043 0.93 MEN1 (0.47) APPBACE1MEN1KMT2AACHE
SCHEMBL16407192 0.92 APP (0.45) APPBACE1MEN1KMT2AACHE
SCHEMBL16405606 0.92 HRH3 (0.45) HRH3APPBACE1
SCHEMBL16407044 0.91 ACHE (0.47) APPMEN1KMT2AACHE
SCHEMBL16405631 0.90 CASP1 (0.43) HRH3APPBACE1CASP1CASP4
SCHEMBL18500787 0.89 MEN1 (0.45) APPBACE1MEN1KMT2AACHE
SCHEMBL18499175 0.88 HRH3 (0.44) HRH3APPBACE1

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-9567316-B2 Aminoquinoline derivatives and uses thereof THE MCLEAN HOSPITAL CORPORATION (US) 2017-02-14 US disclosed
US-20150023930-A1 AMINOQUINOLINE DERIVATIVES AND USES THEREOF THE MCLEAN HOSPITAL CORPORATION (US) 2015-01-22 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-20150023930-A1 AMINOQUINOLINE DERIVATIVES AND USES THEREOF LRRK2, NLN, AADAT HRH3 39/4885APP 219/4885BACE1 614/4885

“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.