SCHEMBL8957014

SCHEMBL8957014

CCN(CC)C(=C(C(=C(c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1)N(CC)CC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
HPGD P15428 3/20 0.44
KMT2A Q03164 1/20 0.42
MAPT P10636 1/20 0.41
MGLL Q99685 1/20 0.40
NPC1 O15118 2/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
PTGS2 P35354 1/20 0.39
ESR1 P03372 3/20 0.38
CYP19A1 P11511 1/20 0.38
ESR2 Q92731 1/20 0.38
LMNA P02545 1/20 0.38
PGR P06401 1/20 0.37
ADRA2A P08913 1/20 0.37
ADRA2B P18089 1/20 0.37
HTR2A P28223 1/20 0.37
HRH1 P35367 1/20 0.37
KCNH2 Q12809 1/20 0.37
L3MBTL1 Q9Y468 2/20 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
SCHEMBL16760711 0.76 CES1 (0.45) ALDH1A1HPGDKMT2AMAPTSMN1; SMN2
SCHEMBL2269339 0.72 ALDH1A1 (0.47) ALDH1A1HPGDKMT2AMAPTMGLL
SCHEMBL9806364 0.69 PTGS2 (0.36) ALDH1A1HPGDKMT2AMAPTNPC1
SCHEMBL6660252 0.69 ESR1 (0.54) ALDH1A1MAPTPTGS2ESR1CYP19A1
SCHEMBL6660254 0.69 ESR1 (0.54) ALDH1A1MAPTPTGS2ESR1CYP19A1
SCHEMBL17955311 0.67 ALDH1A1 (0.50) ALDH1A1HPGDKMT2AMAPTMGLL
SCHEMBL3126210 0.67 ALDH1A1 (0.50) ALDH1A1HPGDKMT2AMAPTMGLL
SCHEMBL72112 0.67 HPGD (0.85) ALDH1A1HPGDMAPTLMNAL3MBTL1
SCHEMBL12411256 0.67 ALDH1A1 (0.50) ALDH1A1HPGDKMT2AMAPTMGLL
SCHEMBL10781316 0.67 ALDH1A1 (0.50) ALDH1A1HPGDKMT2AMAPTMGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5585212-A LAYER HAVING BLEND OF HIGHER AND LOWER MOLECULAR WEIGHT POLYCARBONATES WITH CHARGE GENERATING AND CHARGE TRANSPORTING MATERIALS, SENSITIVITY, DURABILITY, STRENGTH, EASE OF MANUFACTURE MINOLTA CO., LTD. (JP) 1996-12-17 US disclosed
US-4988571-A CHARGE GENERATING LAYER AND A CHARGE TRANSPORTING LAYER LAMINATION, ELECTROGRAPHY MINOLTA CAMERA KABUSHIKI KAISHA (JP) 1991-01-29 US disclosed