SCHEMBL23905332

SCHEMBL23905332

Cc1cc(OC2CC2)c2ncc(C(F)F)cc2c1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.37
PIK3CA P42336 3/20 0.34
PIK3R1 P27986 1/20 0.33
CCR1 P32246 1/20 0.31
CCR5 P51681 1/20 0.31
CCR8 P51685 1/20 0.31
PDGFRB P09619 1/20 0.30
PDGFRA P16234 1/20 0.30
KMO O15229 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
SCHEMBL23958594 0.85 CCR1 (0.44) SYKPIK3CAPIK3R1CCR1CCR5
SCHEMBL23905323 0.83 SYK (0.36) SYKPIK3CAPIK3R1CCR1CCR5
SCHEMBL23958607 0.82 ACHE (0.36) CCR1CCR5CCR8PDGFRBPDGFRA
SCHEMBL23905317 0.80 KDM4E (0.38) PIK3CAPDGFRBPDGFRA
SCHEMBL23904848 0.79 KMO (0.37) KMO
SCHEMBL23905484 0.77 CCR1 (0.40) SYKPIK3CAPIK3R1CCR1CCR5
SCHEMBL30007139 0.70 KMO (0.40) CCR1CCR5CCR8KMO
SCHEMBL23196004 0.70 KMO (0.40) CCR1CCR5CCR8KMO
SCHEMBL23905312 0.70 MCHR1 (0.39) SYKCCR1CCR5CCR8
SCHEMBL30211305 0.69 PARP1 (0.43) CCR1CCR5CCR8KMO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021198981-A1 ANTIVIRAL COMPOUNDS AND USES THEREOF Janssen Biopharma, Inc. (US) 2021-10-07 WO disclosed