SCHEMBL15329779

SCHEMBL15329779

O=Cc1c(-c2ccc(F)cc2)nn(-c2ccc(F)cc2F)c1Br

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
TP53 P04637 1/20 0.38
MAPT P10636 1/20 0.38
POLB P06746 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
OPRM1 P35372 1/20 0.34
ALDH1A1 P00352 1/20 0.33
KMT2A Q03164 1/20 0.33
CNR1 P21554 1/20 0.32
CNR2 P34972 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
SCHEMBL15330925 0.93 LMNA (0.41) LMNANPC1RAB9ATP53MAPT
SCHEMBL15331035 0.92 NPC1 (0.50) LMNANPC1RAB9ATP53MAPT
SCHEMBL15330512 0.91 LMNA (0.38) LMNANPC1RAB9ATP53MAPT
SCHEMBL2553382 0.91 NPC1 (0.37) LMNANPC1RAB9ATP53MAPT
SCHEMBL15330819 0.90 ESR1 (0.38) LMNANPC1RAB9APOLBALDH1A1
SCHEMBL15330979 0.89 NPC1 (0.41) LMNANPC1RAB9ATP53MAPT
SCHEMBL2559077 0.87 POLB (0.41) LMNATP53POLBALDH1A1
SCHEMBL15331412 0.87 L3MBTL1 (0.36) LMNANPC1RAB9AL3MBTL1OPRM1
SCHEMBL2562866 0.86 L3MBTL1 (0.35) LMNANPC1RAB9ATP53MAPT
SCHEMBL2562232 0.85 NPC1 (0.36) LMNANPC1RAB9AL3MBTL1OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
US-11225655-B2 Bi-functional complexes and methods for making and using such complexes NUEVOLUTION A/S (DK) 2022-01-18 US disclosed
EP-3540059-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2019-09-18 EP disclosed
EP-2558577-B1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION AS (DK) 2018-12-12 EP disclosed
US-20130281324-A1 BI-FUNCTINAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2013-10-24 US disclosed