SCHEMBL3523097

SCHEMBL3523097

C/C(=N\O)C(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 6/20 0.43
ALDH1A1 P00352 3/20 0.38
ALOX15 P16050 2/20 0.38
ESR1 P03372 2/20 0.37
ESR2 Q92731 2/20 0.37
CYP3A4 P08684 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
MAPK1 P28482 1/20 0.36
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
GAA P10253 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TSHR P16473 2/20 0.35

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
SCHEMBL3523100 1.00 KCNN4 (0.43) KCNN4ALDH1A1ALOX15ESR1ESR2
SCHEMBL12620700 0.85 ALDH1A1 (0.50) KCNN4ALDH1A1ALOX15MAPK1MAPT
SCHEMBL364200 0.84 SMN1; SMN2 (0.34) KCNN4ALDH1A1CYP1A2MAPTKMT2A
SCHEMBL363274 0.82 NPC1 (0.35) KCNN4KMT2ATSHR
SCHEMBL365534 0.82 NPC1 (0.35) KCNN4KMT2ATSHR
SCHEMBL3520335 0.79 KCNN4 (0.42) KCNN4ALDH1A1ALOX15CYP1A2CYP2C9
SCHEMBL3520337 0.79 KCNN4 (0.42) KCNN4ALDH1A1ALOX15CYP1A2CYP2C9
SCHEMBL364047 0.78 KCNN4 (0.31) KCNN4ALDH1A1
SCHEMBL3498120 0.77 ALDH1A1 (0.40) ALDH1A1ALOX15ESR1ESR2CYP3A4
SCHEMBL3498122 0.77 ALDH1A1 (0.40) ALDH1A1ALOX15ESR1ESR2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7709533-B2 Imines as ion channel modulators ICAGEN, INC. (US) 2010-05-04 US disclosed
EP-1861356-A1 IMINES AS ION CHANNEL MODULATORS Icagen, Inc. (US) 2007-12-05 EP disclosed
US-20060178346-A1 Imines as ion channel modulators ICAGEN, INC. (US) 2006-08-10 US disclosed
WO-2006084031-A1 IMINES AS ION CHANNEL MODULATORS ICAGEN, INC. (US) 2006-08-10 WO 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-20060178346-A1 Imines as ion channel modulators KCNN1, KCNN3, KCNN2 KCNN4 4/4885ALDH1A1 3494/4885ALOX15 1830/4885

“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.