SCHEMBL5495738

SCHEMBL5495738

CCCCCC(C)c1ccnc(-c2cc(C(C)CCCCC)ccn2)c1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 2/20 0.36
CCR1 P32246 2/20 0.35
CCR5 P51681 2/20 0.35
CCR8 P51685 2/20 0.35
ADA P00813 2/20 0.34
KDM4E B2RXH2 2/20 0.33
BDKRB2 P30411 1/20 0.33
HPGD P15428 1/20 0.33
SLC2A1 P11166 1/20 0.33
NR1I2 O75469 1/20 0.33
OPRM1 P35372 1/20 0.32
KDM5A P29375 1/20 0.32
ADRB2 P07550 1/20 0.32

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
SCHEMBL5973792 0.98 GPR84 (0.38) GPR84CCR1CCR5CCR8ADA
SCHEMBL11801461 0.90 CYP1A2 (0.41) CCR1CCR5CCR8KDM4E
SCHEMBL22298879 0.85 UHRF1 (0.38) GPR84ADAKDM4EBDKRB2HPGD
SCHEMBL18879378 0.83 KDM4E (0.38) GPR84ADAKDM4EBDKRB2HPGD
SCHEMBL22299579 0.83 LOXL2 (0.36) GPR84ADAKDM4EBDKRB2HPGD
SCHEMBL174988 0.83 NR1I2 (0.39) GPR84CCR1CCR5CCR8ADA
SCHEMBL22260647 0.82 GPR84 (0.37) GPR84ADAKDM4EBDKRB2HPGD
SCHEMBL18855187 0.82 NOS3 (0.42) GPR84ADAKDM4EHPGDSLC2A1
SCHEMBL22299306 0.81 LOX (0.41) GPR84KDM4EHPGDSLC2A1
SCHEMBL5974098 0.80 NR1I2 (0.47) GPR84CCR1CCR5CCR8ADA

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-7291427-B2 Surface graft material, conductive pattern material, and production method thereof FUJIFILM CORPORATION (JP) 2007-11-06 US disclosed
US-20050208428-A1 Surface graft material, conductive pattern material, and production method thereof FUJI PHOTO FILM CO., LTD. 2005-09-22 US disclosed