SCHEMBL18612901

SCHEMBL18612901

CNC(C)c1ccc(Cl)cc1C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR2A P28223 8/20 0.56
▸ SLC6A4 P31645 7/20 0.56
▸ KCNH2 Q12809 6/20 0.56
▸ HTT P42858 2/20 0.42
▸ LMNA P02545 1/20 0.42
▸ TP53 P04637 1/20 0.42
▸ MEN1 O00255 4/20 0.39
▸ KMT2A Q03164 4/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ GPR139 Q6DWJ6 3/20 0.38
▸ TSHR P16473 1/20 0.38
▸ HTR2C P28335 1/20 0.38
▸ HTR2B P41595 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ NOX1 Q9Y5S8 1/20 0.37

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
SCHEMBL19965517 0.82 LMNA (0.59) HTR2ASLC6A4KCNH2HTTLMNA
SCHEMBL8298242 0.82 LMNA (0.59) HTR2ASLC6A4KCNH2HTTLMNA
SCHEMBL8353840 0.82 LMNA (0.59) HTR2ASLC6A4KCNH2HTTLMNA
SCHEMBL8285947 0.79 HTR2A (0.46) HTR2ASLC6A4KCNH2LMNATP53
SCHEMBL8285948 0.79 HTR2A (0.46) HTR2ASLC6A4KCNH2LMNATP53
SCHEMBL178621 0.79 HTR2A (0.46) HTR2ASLC6A4KCNH2LMNATP53
SCHEMBL1911434 0.79 LMNA (0.48) HTR2ASLC6A4KCNH2HTTLMNA
SCHEMBL9070739 0.78 SLC6A4 (0.50) HTR2ASLC6A4KCNH2HTTLMNA
SCHEMBL178490 0.78 SLC6A4 (0.50) HTR2ASLC6A4KCNH2HTTLMNA
SCHEMBL30202757 0.77 GPR139 (0.47) HTR2ALMNAMEN1KMT2AMAPT

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-20170066753-A1 OXADIAZINE COMPOUNDS AND METHODS OF USE THEREOF DENALI THERAPEUTICS, INC. 2017-03-09 — — 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-20170066753-A1 OXADIAZINE COMPOUNDS AND METHODS OF USE THEREOF PSEN2, SMN1; SMN2, OTC HTR2A 189/4885SLC6A4 599/4885KCNH2 3755/4885

“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.

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