SCHEMBL7718267

SCHEMBL7718267

C(=C/c1ccc(N2CCCCC2)cc1)\c1ccc(N2CCCCC2)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.69
KDM4E B2RXH2 2/20 0.69
SMN1; SMN2 Q16637 2/20 0.69
MAPT P10636 6/20 0.68
PTGS2 P35354 3/20 0.66
TRIM24 O15164 1/20 0.65
TRIM33 Q9UPN9 1/20 0.65
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
NPC1 O15118 1/20 0.56
USP2 O75604 1/20 0.56
TP53 P04637 1/20 0.56
POLB P06746 1/20 0.56
GAA P10253 1/20 0.56
THRB P10828 1/20 0.56
ALOX15 P16050 1/20 0.56
HTT P42858 1/20 0.56
RECQL P46063 1/20 0.56
RAB9A P51151 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56

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
SCHEMBL7718270 1.00 ALDH1A1 (0.69) ALDH1A1KDM4ESMN1; SMN2MAPTPTGS2
SCHEMBL13766546 0.98 TRIM24 (0.68) ALDH1A1KDM4ESMN1; SMN2MAPTPTGS2
SCHEMBL9915657 0.90 MAPT (0.65) ALDH1A1KDM4ESMN1; SMN2MAPTPTGS2
SCHEMBL10770812 0.90 MAPT (0.58) ALDH1A1KDM4ESMN1; SMN2MAPTPTGS2
SCHEMBL10771126 0.89 PTGS2 (0.59) ALDH1A1KDM4ESMN1; SMN2MAPTPTGS2
SCHEMBL11589270 0.88 MAPT (0.57) ALDH1A1KDM4ESMN1; SMN2MAPTPTGS2
SCHEMBL11589274 0.88 MAPT (0.57) ALDH1A1KDM4ESMN1; SMN2MAPTPTGS2
SCHEMBL10772793 0.87 MAPT (0.60) ALDH1A1KDM4ESMN1; SMN2MAPTPTGS2
SCHEMBL1136730 0.87 PTGS2 (0.62) ALDH1A1KDM4ESMN1; SMN2MAPTPTGS2
SCHEMBL1136732 0.87 PTGS2 (0.62) ALDH1A1KDM4ESMN1; SMN2MAPTPTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8197722-B2 Irradiating the compound (containing two electron donor groups and a bridge of pi-conjugated bonds containing electron donor groups) with light, and the compound is converted to a multi-photon electronically excited state THE CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2012-06-12 US disclosed
US-8197722-B2 Irradiating the compound (containing two electron donor groups and a bridge of pi-conjugated bonds containing electron donor groups) with light, and the compound is converted to a multi-photon electronically excited state THE CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2012-06-12 US disclosed
US-8197722-B2 Irradiating the compound (containing two electron donor groups and a bridge of pi-conjugated bonds containing electron donor groups) with light, and the compound is converted to a multi-photon electronically excited state THE CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2012-06-12 US disclosed
US-20020185634-A1 Two-photon or higher-order absorbing optical materials and methods of use CALIFORNIA INSTITUTE OF TECHNOLOGY 2002-12-12 US disclosed
WO-1998021521-A9 TWO-PHOTON OR HIGHER-ORDER ABSORBING OPTICAL MATERIALS AND METHODS OF USE CALIFORNIA INST OF TECHN (US) 2000-03-02 WO disclosed
WO-1998021521-A1 TWO-PHOTON OR HIGHER-ORDER ABSORBING OPTICAL MATERIALS AND METHODS OF USE CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 1998-05-22 WO disclosed