SCHEMBL19086855

SCHEMBL19086855

[CH2]c1cn2cc(Cl)ccc2n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 9/20 0.56
NPC1 O15118 6/20 0.56
KDM4E B2RXH2 8/20 0.50
TP53 P04637 1/20 0.50
ALDH1A1 P00352 7/20 0.49
MAPT P10636 5/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
POLB P06746 3/20 0.49
LMNA P02545 1/20 0.49
CASP3 P42574 1/20 0.49
SENP8 Q96LD8 1/20 0.49
SENP7 Q9BQF6 1/20 0.49
SENP6 Q9GZR1 1/20 0.49
APP P05067 1/20 0.46
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
HRH4 Q9H3N8 1/20 0.42
HRH3 Q9Y5N1 1/20 0.42
HPGD P15428 1/20 0.42
TSHR P16473 1/20 0.42

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
SCHEMBL7911725 0.78 RAB9A (0.60) RAB9ANPC1KDM4ETP53ALDH1A1
SCHEMBL4790790 0.77 NPC1 (0.55) RAB9ANPC1KDM4ETP53ALDH1A1
SCHEMBL3486359 0.75 PIK3CG (0.60) RAB9ANPC1KDM4ETP53ALDH1A1
SCHEMBL433724 0.75 RAB9A (0.56) RAB9ANPC1KDM4ETP53ALDH1A1
SCHEMBL12778714 0.75 RAB9A (0.56) RAB9ANPC1KDM4ETP53ALDH1A1
SCHEMBL16087132 0.75 APP (0.46) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL286467 0.72 KDM4E (0.65) RAB9ANPC1KDM4ETP53ALDH1A1
SCHEMBL1691409 0.72 RAB9A (1.00) RAB9ANPC1KDM4EALDH1A1MAPT
SCHEMBL9598420 0.71 KDM4E (0.63) RAB9ANPC1KDM4ETP53ALDH1A1
SCHEMBL8812209 0.71 SCN5A (0.53) RAB9ANPC1KDM4ETP53ALDH1A1

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-2999338-B1 KNOWN AND NOVEL HETEROCYCLIC COMPOUNDS AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2017-07-12 EP disclosed