SCHEMBL11093687

SCHEMBL11093687

CCN1CCN(C(=O)NC(C(=O)Cl)c2ccccc2F)C(=O)C1=O

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 8/20 0.37
▸ POLB P06746 1/20 0.36
▸ KCNQ2 O43526 1/20 0.36
▸ TP53 P04637 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ CNR2 P34972 2/20 0.34
▸ P2RX7 Q99572 1/20 0.34
▸ OPRM1 P35372 1/20 0.34
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 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
SCHEMBL8600205 0.85 POLB (0.40) POLBMEN1KMT2A
SCHEMBL10543158 0.85 POLB (0.40) POLBMEN1KMT2A
SCHEMBL10596773 0.80 SMN1; SMN2 (0.33) POLBTP53SMN1; SMN2
SCHEMBL10402624 0.80 POLB (0.36) POLBSMN1; SMN2MEN1KMT2A
SCHEMBL28473803 0.79 MAPT (0.43) POLBTP53SMN1; SMN2MEN1KMT2A
SCHEMBL28435235 0.79 MAPT (0.43) POLBTP53SMN1; SMN2MEN1KMT2A
SCHEMBL10401841 0.79 HDAC1 (0.41) POLBTP53MEN1KMT2A
SCHEMBL10377087 0.77 SMN1; SMN2 (0.34) POLBSMN1; SMN2
SCHEMBL8597022 0.77 ATM (0.42) POLBMEN1KMT2A
SCHEMBL7828421 0.77 ATM (0.42) POLBMEN1KMT2A

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-0114750-A2 Beta-lactam antibacterial agents BEECHAM GROUP PLC (GB) 1984-08-01 — — EP disclosed
Send feedback