SCHEMBL91283

SCHEMBL91283

CCc1cc(CCOC)ccc1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.42
KDM4E B2RXH2 3/20 0.39
ALDH1A1 P00352 1/20 0.39
BACE1 P56817 1/20 0.39
REN P00797 2/20 0.38
KCNH2 Q12809 2/20 0.38
HPGD P15428 1/20 0.37
TSHR P16473 1/20 0.37
CA2 P00918 1/20 0.36
AKT1 P31749 1/20 0.36
HTR2A P28223 1/20 0.36
SLC6A4 P31645 1/20 0.36
PNMT P11086 1/20 0.36
TAAR1 Q96RJ0 1/20 0.36
P4HB P07237 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
GLA P06280 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
GAA P10253 1/20 0.35

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
SCHEMBL91281 0.90 L3MBTL1 (0.43) GPR84L3MBTL1KDM4EALDH1A1BACE1
SCHEMBL662701 0.84 TSHR (0.39) ALDH1A1RENKCNH2HPGDTSHR
SCHEMBL8251205 0.82 HTR1A (0.44) L3MBTL1ALDH1A1TSHRHTR2ASMN1; SMN2
SCHEMBL660708 0.81 SLC6A4 (0.47) KCNH2TSHRHTR2ASLC6A4SIGMAR1
SCHEMBL16771200 0.81 PNMT (0.55) ALDH1A1KCNH2HPGDTSHRPNMT
SCHEMBL3790563 0.78 TRPA1 (0.43) GPR84L3MBTL1KDM4EALDH1A1BACE1
SCHEMBL664960 0.78 MRGPRX4 (0.50) KDM4EALDH1A1HPGDTSHRSMN1; SMN2
SCHEMBL8037422 0.78 GPR84 (0.41) GPR84KDM4EALDH1A1KCNH2HPGD
SCHEMBL44646 0.78 BACE1 (0.62) KDM4EALDH1A1BACE1HTR2APNMT
SCHEMBL667234 0.78 NR3C1 (0.43) L3MBTL1KDM4EALDH1A1RENKCNH2

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-8129538-B1 Renin inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-03-06 US disclosed