SCHEMBL9555484

SCHEMBL9555484

COC(=O)N1c2ccccc2C=Cc2ccccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
P2RX4 Q99571 16/20 1.00
BCHE P06276 1/20 0.61
LMNA P02545 1/20 0.58
TSHR P16473 1/20 0.58
MAPK1 P28482 1/20 0.58
SCN4A P35499 1/20 0.58
SCN5A Q14524 1/20 0.58
SCN9A Q15858 1/20 0.58
P2RX1 P51575 5/20 0.56
P2RX3 P56373 5/20 0.56
P2RX7 Q99572 2/20 0.56
MTNR1A P48039 1/20 0.54
MTNR1B P49286 1/20 0.54
PTBP1 P26599 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53

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
SCHEMBL11412073 0.81 P2RX4 (0.71) P2RX4BCHELMNATSHRMAPK1
SCHEMBL18415539 0.81 P2RX4 (0.69) P2RX4LMNATSHRMAPK1SCN4A
SCHEMBL7980250 0.78 P2RX4 (0.67) P2RX4LMNATSHRMAPK1SCN4A
SCHEMBL1572434 0.77 P2RX4 (0.62) P2RX4BCHELMNATSHRMAPK1
SCHEMBL12436609 0.77 P2RX4 (0.62) P2RX4BCHELMNATSHRMAPK1
SCHEMBL13051502 0.77 BCHE (0.68) P2RX4BCHEP2RX1P2RX3P2RX7
SCHEMBL11113845 0.77 P2RX4 (0.67) P2RX4BCHELMNATSHRMAPK1
SCHEMBL8739119 0.76 BCHE (1.00) P2RX4BCHELMNASMN1; SMN2
SCHEMBL220840 0.75 P2RX4 (0.59) P2RX4LMNATSHRMAPK1SCN4A
SCHEMBL15603438 0.74 P2RX4 (0.66) P2RX4LMNATSHRMAPK1SCN4A

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-5185443-A Method for preparing 5-carbamoyl-5H-dibenz[b,f]azepine ARZNEIMITTELWERK DRESDEN GMBH (DE) 1993-02-09 US disclosed