SCHEMBL18657232

SCHEMBL18657232

NC(=O)CN1CCC(Cc2ccccc2)C1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.58
TACR3 P29371 1/20 0.56
CARM1 Q86X55 2/20 0.55
PRMT6 Q96LA8 2/20 0.55
CCR3 P51677 2/20 0.54
PRMT3 O60678 1/20 0.54
PRMT1 Q99873 1/20 0.54
PRMT8 Q9NR22 1/20 0.54
GRIN2B Q13224 2/20 0.53
GRIN2D O15399 1/20 0.53
GRIN3B O60391 1/20 0.53
ADRA1D P25100 1/20 0.53
ADRA1A P35348 1/20 0.53
ADRA1B P35368 1/20 0.53
GRIN1 Q05586 1/20 0.53
GRIN2A Q12879 1/20 0.53
GRIN2C Q14957 1/20 0.53
GRIN3A Q8TCU5 1/20 0.53
ACHE P22303 1/20 0.51
KDM4E B2RXH2 1/20 0.51

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
SCHEMBL4281407 0.91 GAA (0.64) GAACARM1PRMT6CCR3PRMT3
SCHEMBL19382678 0.85 GRIN2D (0.56) TACR3CARM1PRMT6CCR3GRIN2B
SCHEMBL3867284 0.79 PRMT3 (0.66) GAACARM1PRMT6CCR3PRMT3
SCHEMBL21763292 0.79 TACR3 (0.71) GAATACR3
SCHEMBL4023997 0.78 GRIN2B (0.66) GAACARM1PRMT6CCR3PRMT3
SCHEMBL27332314 0.78 CTSS (0.53) ACHE
SCHEMBL23719076 0.78 CCR3 (0.80) GAACARM1PRMT6CCR3PRMT3
SCHEMBL8262506 0.78 CCR3 (0.80) GAACARM1PRMT6CCR3PRMT3
SCHEMBL6218861 0.78 CCR3 (0.80) GAACARM1PRMT6CCR3PRMT3
SCHEMBL5888792 0.77 HTR7 (0.68) CARM1PRMT6CCR3PRMT3PRMT1

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-2393794-B1 DESIGN, SYNTHESIS AND EVALUATION OF PROCASPASE ACTIVATING COMPOUNDS AS PERSONALIZED ANTI-CANCER DRUGS UNIV ILLINOIS (US) 2017-03-22 EP disclosed