SCHEMBL16743583

SCHEMBL16743583

Cc1n[nH]c(-c2nc(C(F)(F)F)n[nH]2)n1

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.31
NPC1 O15118 1/20 0.31
POLB P06746 1/20 0.31
RAB9A P51151 1/20 0.31
ATM Q13315 1/20 0.31

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
SCHEMBL15375204 0.87 KDM4E (0.32) KDM4ENPC1POLBRAB9AATM
SCHEMBL15627396 0.83 NPC1 (0.32) KDM4ENPC1POLBRAB9AATM
SCHEMBL15374804 0.79 DCUN1D1 (0.32)
SCHEMBL10208108 0.69 POLB (0.37) KDM4EPOLBRAB9A
SCHEMBL13153061 0.68 NR1H2 (0.55) KDM4ENPC1POLBRAB9AATM
SCHEMBL16680999 0.68 NPC1 (0.37) KDM4ENPC1RAB9A
SCHEMBL503528 0.68 CCR1 (0.47) KDM4ENPC1RAB9A
SCHEMBL16115547 0.66 NPC1 (0.51) KDM4ENPC1POLBRAB9AATM
SCHEMBL1187565 0.66 LMNA (0.38) POLBRAB9A
SCHEMBL19221149 0.65 AOC3 (0.31) RAB9A

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
US-9040702-B1 Luminescent platinum(II) complexes with biazolate chelates NATIONAL TSING HUA UNIVERSITY (TW) 2015-05-26 US disclosed