SCHEMBL11047876

SCHEMBL11047876

Cc1ccccc1-n1cnc(CCl)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CPB1 P15086 2/20 0.51
CPB2 Q96IY4 2/20 0.51
RXRA P19793 5/20 0.37
GRIN1 Q05586 5/20 0.37
GRIN2B Q13224 5/20 0.37
FLT3 P36888 1/20 0.36
GSK3B P49841 1/20 0.36
PI4KA P42356 1/20 0.34
PI4K2B Q8TCG2 1/20 0.34
PI4K2A Q9BTU6 1/20 0.34
PI4KB Q9UBF8 1/20 0.34
HCAR1 Q9BXC0 1/20 0.34
ALDH1A1 P00352 2/20 0.33
MGLL Q99685 1/20 0.33
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TSHR P16473 2/20 0.33
ELANE P08246 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
ADRB1 P08588 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
SCHEMBL11046403 0.83 CPB1 (0.54) CPB1CPB2RXRAGRIN1GRIN2B
SCHEMBL20162954 0.80 NOTUM (0.40) CPB1CPB2PI4KAPI4K2BPI4K2A
SCHEMBL30037434 0.80 NOTUM (0.40) CPB1CPB2PI4KAPI4K2BPI4K2A
SCHEMBL29563229 0.80 KDM4E (0.40) CPB1CPB2ALDH1A1HPGDSMN1; SMN2
SCHEMBL15633080 0.77 CYP2E1 (0.47) CPB1CPB2FLT3GSK3BPI4KA
SCHEMBL27163123 0.75 CPB2 (0.47) CPB1CPB2
SCHEMBL28734546 0.72 P2RX3 (0.37) ELANE
SCHEMBL27786860 0.71 CPB2 (0.47) CPB1CPB2ALDH1A1SMN1; SMN2TDP1
SCHEMBL28073106 0.71 CPB1 (0.43) CPB1CPB2FLT3GSK3BPI4KA
SCHEMBL27786917 0.71 KDM4E (0.55) CPB1CPB2ALDH1A1HPGDSMN1; SMN2

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-0024829-B1 4-BENZYL- AND 4-BENZOYLIMIDAZOLE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME Farmos-Yhtyma Oy (FI) 1984-04-25 EP disclosed
US-4443466-A DIURETICS, SEDATIVES, ANALGESICS Farmos-Yhtyma OY (Farmos Group Ltd.) (FI) 1984-04-17 US disclosed