SCHEMBL8772379

SCHEMBL8772379

C=CCN(CC=C)c1ccccc1S

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
C5AR1 P21730 1/20 0.37
CYP1A2 P05177 2/20 0.33
PTPN1 P18031 1/20 0.32
ALDH1A1 P00352 3/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
TSHR P16473 1/20 0.32
CYP2C19 P33261 1/20 0.32
LMNA P02545 1/20 0.32
HTT P42858 1/20 0.32
POLB P06746 2/20 0.32
NPC1 O15118 1/20 0.32
PKM P14618 1/20 0.32
HPGD P15428 1/20 0.32
RAB9A P51151 1/20 0.32
ALOX5 P09917 1/20 0.31
CHKA P35790 1/20 0.31
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30

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
SCHEMBL7302336 0.80 C5AR1 (0.35) C5AR1CYP1A2ALDH1A1CYP3A4CYP2D6
SCHEMBL5147072 0.79 C5AR1 (0.37) C5AR1CYP1A2PTPN1ALDH1A1CYP3A4
SCHEMBL3266720 0.78 C5AR1 (0.36) C5AR1CYP1A2PTPN1ALDH1A1LMNA
SCHEMBL9064675 0.77 C5AR1 (0.36) C5AR1CYP1A2POLBKDM4EMEN1
SCHEMBL3631013 0.77 C5AR1 (0.38) C5AR1CYP1A2PTPN1ALDH1A1LMNA
SCHEMBL5573303 0.75 PTPN1 (0.40) C5AR1CYP1A2PTPN1ALDH1A1CYP3A4
SCHEMBL2325772 0.75 C5AR1 (0.37) C5AR1CYP1A2PTPN1ALDH1A1LMNA
SCHEMBL556848 0.75 C5AR1 (0.37) C5AR1CYP1A2PTPN1ALDH1A1CYP3A4
SCHEMBL473072 0.75 ALDH1A1 (0.40) C5AR1CYP1A2PTPN1ALDH1A1CYP3A4
SCHEMBL10352409 0.75 ALDH1A1 (0.40) C5AR1CYP1A2PTPN1ALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5283016-A Method for preparing photosensitive microcapsules THE MEAD CORPORATION (US) 1994-02-01 US claimed
EP-0387087-B1 Photoinitiator compositions, photohardenable compositions and photosensitive microcapsules CYCOLOR INC (US) 1997-10-08 EP disclosed
US-5283016-A Method for preparing photosensitive microcapsules THE MEAD CORPORATION (US) 1994-02-01 US disclosed
EP-0434437-A2 Photohardenable or thermohardenable compositions and photosensitive materials utilising such photohardenable compositions THE MEAD CORPORATION (US) 1991-06-26 EP disclosed
EP-0387086-A2 Photoinitiator compositions, photohardenable compositions containing the same THE MEAD CORPORATION (US) 1990-09-12 EP disclosed
EP-0387087-A2 Photoinitiator compositions, photohardenable compositions and photosensitive microcapsules THE MEAD CORPORATION (US) 1990-09-12 EP disclosed
US-4954415-A Photoresists, photolithography THE MEAD CORPORATION (US) 1990-09-04 US disclosed