SCHEMBL29419005

SCHEMBL29419005

O=C(C=Cc1cccc2ccccc12)c1ccccc1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.77
SMN1; SMN2 Q16637 3/20 0.77
ALDH1A1 P00352 2/20 0.77
HPGD P15428 2/20 0.77
CYP1A2 P05177 2/20 0.77
CYP1B1 Q16678 2/20 0.77
CYP1A1 P04798 1/20 0.77
CYP2D6 P10635 1/20 0.77
NPY1R P25929 1/20 0.77
MAPK1 P28482 1/20 0.77
NPY2R P49146 1/20 0.77
HDAC8 Q9BY41 1/20 0.61
HDAC6 Q9UBN7 1/20 0.61
NPC1 O15118 3/20 0.56
RAB9A P51151 3/20 0.56
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
NFKB1 P19838 1/20 0.56
NFKB2 Q00653 1/20 0.56
RELA Q04206 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
SCHEMBL979175 1.00 MAPT (0.77) MAPTSMN1; SMN2ALDH1A1HPGDCYP1A2
SCHEMBL29876093 1.00 MAPT (0.77) MAPTSMN1; SMN2ALDH1A1HPGDCYP1A2
SCHEMBL9584082 1.00 MAPT (0.77) MAPTSMN1; SMN2ALDH1A1HPGDCYP1A2
SCHEMBL28692733 0.89 MAPT (0.63) MAPTSMN1; SMN2ALDH1A1HPGDCYP1A2
SCHEMBL2704174 0.87 CYP1A1 (1.00) MAPTSMN1; SMN2ALDH1A1HPGDCYP1A2
SCHEMBL17541840 0.87 MAPT (0.61) MAPTSMN1; SMN2ALDH1A1HPGDCYP1A2
SCHEMBL657392 0.87 MAPT (0.69) MAPTSMN1; SMN2ALDH1A1HPGDCYP1A2
SCHEMBL14416406 0.87 MAPT (0.69) MAPTSMN1; SMN2ALDH1A1HPGDCYP1A2
SCHEMBL7641855 0.87 MAPT (0.69) MAPTSMN1; SMN2ALDH1A1HPGDCYP1A2
SCHEMBL657391 0.87 MAPT (0.69) MAPTSMN1; SMN2ALDH1A1HPGDCYP1A2

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
CN-109037448-B Method for controllably preparing organic semiconductor nanowire under synergistic effect 苏州大学 2022-03-11 CN claimed
CN-111334292-B Triblock multi-color luminescent organic micro-nano crystal and preparation and application thereof 苏州大学 2022-04-01 CN disclosed
CN-111394093-B One-dimensional core-shell triblock multi-color luminescent organic micro-nano crystal and preparation and application thereof 苏州大学 2022-04-01 CN disclosed
CN-109037448-B Method for controllably preparing organic semiconductor nanowire under synergistic effect 苏州大学 2022-03-11 CN disclosed