SCHEMBL23936800

SCHEMBL23936800

NCCN1CCC(NI)CC1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.50
CARM1 Q86X55 3/20 0.41
PRMT6 Q96LA8 3/20 0.41
PRMT1 Q99873 2/20 0.41
PRMT8 Q9NR22 2/20 0.41
PRMT3 O60678 1/20 0.41
GNAI3 P08754 3/20 0.39
GNAO1 P09471 3/20 0.39
GNAI1 P63096 3/20 0.39
ACE2 Q9BYF1 1/20 0.35
SIGMAR1 Q99720 1/20 0.32
SMYD3 Q9H7B4 1/20 0.31
CHRM3 P20309 1/20 0.31
POLB P06746 1/20 0.31
HTT P42858 1/20 0.31

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
SCHEMBL23936818 0.81 SIGMAR1 (0.37) ALOX15SIGMAR1
SCHEMBL14173452 0.78 ALOX15 (0.50) ALOX15CARM1PRMT6PRMT1PRMT8
SCHEMBL23936819 0.77
SCHEMBL22878309 0.75 ALOX15 (0.57) ALOX15CARM1PRMT6PRMT1PRMT8
SCHEMBL18551063 0.74 KDM1A (0.48) CARM1PRMT6PRMT1PRMT8
SCHEMBL21214025 0.74 ALOX15 (0.44) ALOX15CARM1PRMT6PRMT1PRMT8
SCHEMBL12965954 0.73 SMN1; SMN2 (0.42)
SCHEMBL19924787 0.72 SIGMAR1 (0.44) ALOX15CARM1PRMT6PRMT1PRMT8
SCHEMBL20402780 0.72 RAD52 (0.50) ALOX15CARM1PRMT6PRMT1PRMT8
SCHEMBL508627 0.72 ALOX15 (0.60) ALOX15CARM1PRMT6PRMT1PRMT8

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-3475277-B1 ANTI-INFECTIVE HETEROCYCLIC COMPOUNDS AND USES THEREOF BIOIMICS AB (SE) 2021-10-20 EP disclosed