SCHEMBL20343735

SCHEMBL20343735

CCc1c[nH]c(-c2nc(N)c(NC)c(N(C=O)Cc3ccccc3)n2)n1

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 1/20 0.32
▸ CRHR1 P34998 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
SCHEMBL19945786 0.77 RAB9A (0.37) RAB9ACRHR1
SCHEMBL20343818 0.75 HPGD (0.39) RAB9A
SCHEMBL20343740 0.73 SLC26A6 (0.37) RAB9A
SCHEMBL19945665 0.73 ABCB1 (0.38) RAB9A
SCHEMBL19945803 0.68 ALDH1A1 (0.33) —
SCHEMBL21319007 0.67 RAB9A (0.31) RAB9A
SCHEMBL21318994 0.67 TLR7 (0.33) RAB9A
SCHEMBL19945798 0.67 KCNQ3 (0.32) —
SCHEMBL19945582 0.65 HTT (0.34) RAB9A
SCHEMBL21318999 0.64 CHRNA7 (0.37) —

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
EP-2776439-B1 PURINE DERIVATIVES FOR THE TREATMENT OF VIRAL INFECTIONS JANSSEN SCIENCES IRELAND UC (IE) 2018-07-04 — — EP disclosed
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