SCHEMBL393291

SCHEMBL393291

Nc1cccc(Oc2cccc(N)c2Cc2ccccc2)c1Cc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CALM1 P0DP23 1/20 0.42
HPGD P15428 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ALDH1A1 P00352 4/20 0.39
LOXL2 Q9Y4K0 1/20 0.39
TDP1 Q9NUW8 2/20 0.39
ADRA2B P18089 1/20 0.39
PTGS1 P23219 1/20 0.39
MAPT P10636 2/20 0.38
POLB P06746 1/20 0.38
KDM4E B2RXH2 1/20 0.38
CRHBP P24387 1/20 0.38
CRHR2 Q13324 1/20 0.38
PARP1 P09874 1/20 0.38
MAPK1 P28482 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
GAA P10253 1/20 0.37
DPP4 P27487 1/20 0.37
APP P05067 1/20 0.37
LTA4H P09960 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
SCHEMBL27984159 0.87 ALDH1A1 (0.53) ALDH1A1TDP1ADRA2BPTGS1GAA
SCHEMBL6557214 0.85 CALM1 (0.52) CALM1SMN1; SMN2ALDH1A1LOXL2MAPT
SCHEMBL27640492 0.84 CALM1 (0.42) CALM1HPGDSMN1; SMN2ALDH1A1LOXL2
Hydrochloric Acid SCHEMBL2873364 0.83 CALM1 (0.50) CALM1SMN1; SMN2ALDH1A1LOXL2MAPT
Alcohol SCHEMBL28228430 0.83 ALDH1A1 (0.48) ALDH1A1TDP1ADRA2BPTGS1LTA4H
SCHEMBL1498780 0.78 CALM1 (0.55) CALM1SMN1; SMN2ALDH1A1LOXL2MAPT
SCHEMBL7669757 0.78 CALM1 (0.44) CALM1HPGDSMN1; SMN2ALDH1A1LOXL2
SCHEMBL9816698 0.78 DPP4 (0.50) CALM1ALDH1A1MAPTPOLBKDM4E
SCHEMBL7033288 0.78 HPGD (0.49) CALM1HPGDSMN1; SMN2L3MBTL1CYP1A2
SCHEMBL398862 0.78 HTR2A (0.48) CALM1HPGDSMN1; SMN2LOXL2POLB

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-8101655-B2 Fluorescent dyes and complexes SMITH GERALD ARTHUR (GB) 2012-01-24 US disclosed
US-20100256399-A1 FLUORESCENT DYES AND COMPLEXES CAMBRIDGE ENTERPRISE LIMITED (GB) 2010-10-07 US disclosed
US-7674918-B2 Fluorescent dyes and complexes CAMBRIDGE ENTERPRISE LIMITED (GB) 2010-03-09 US disclosed
US-20070238884-A1 Fluorescent Dyes and Complexes CAMBRIDGE ENTERPRISE LIMITED (GB) 2007-10-11 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-20070238884-A1 Fluorescent Dyes and Complexes F12, PYM1, ANXA6 CALM1 2563/4885HPGD 3198/4885SMN1; SMN2 3665/4885
US-20100256399-A1 FLUORESCENT DYES AND COMPLEXES F12, ANXA6, PYM1 CALM1 2294/4885HPGD 2826/4885SMN1; SMN2 3425/4885

“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.