SCHEMBL4442200

SCHEMBL4442200

OCCc1cc2c(Cl)cccc2nc1Cl

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.40
PDE3B Q13370 1/20 0.40
PDE3A Q14432 1/20 0.40
P2RX7 Q99572 1/20 0.36
TDP1 Q9NUW8 2/20 0.35
RAD52 P43351 2/20 0.35
KDM4E B2RXH2 3/20 0.34
ALDH1A1 P00352 2/20 0.34
CYP1A2 P05177 3/20 0.33
LMNA P02545 3/20 0.33
CYP2A6 P11509 2/20 0.33
MAPT P10636 2/20 0.33
TAAR1 Q96RJ0 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
TOP2A P11388 1/20 0.33
TOP2B Q02880 1/20 0.33
MEN1 O00255 1/20 0.33
MAP4K4 O95819 1/20 0.33

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
SCHEMBL21435085 0.87 KDM4E (0.45) KMT2APDE3BPDE3ATDP1RAD52
SCHEMBL4440621 0.85 KMT2A (0.45) KMT2APDE3BPDE3ATDP1KDM4E
SCHEMBL4435275 0.77 NT5E (0.44) KMT2AKDM4EALDH1A1CYP1A2MAPT
SCHEMBL4437045 0.75 L3MBTL1 (0.40) KMT2AP2RX7KDM4EALDH1A1CYP1A2
SCHEMBL4437069 0.74 PDE10A (0.47) KMT2ATDP1KDM4EALDH1A1LMNA
SCHEMBL6983102 0.71 KDM4E (0.46) KMT2ARAD52KDM4EALDH1A1CYP1A2
SCHEMBL11599658 0.71 KDM4E (0.47) KMT2APDE3BPDE3ATDP1KDM4E
SCHEMBL6175786 0.71 P2RX7 (0.40) KMT2AP2RX7TDP1RAD52KDM4E
SCHEMBL5526828 0.71 KDM4E (0.43) KMT2ATDP1KDM4EALDH1A1LMNA
SCHEMBL10251704 0.71 KMT2A (0.51) KMT2AKDM4EALDH1A1MEN1GLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2137186-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES Amgen Inc. (US) 2009-12-30 EP disclosed
WO-2008118468-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2008-10-02 WO disclosed