SCHEMBL23615993

SCHEMBL23615993

CN(CCN)Cc1ccc(F)cc1

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CARM1 Q86X55 4/20 0.66
▸ PRMT6 Q96LA8 2/20 0.66
▸ PRMT8 Q9NR22 1/20 0.66
▸ PYCR1 P32322 2/20 0.55
▸ AOC3 Q16853 1/20 0.50
▸ TAAR1 Q96RJ0 2/20 0.48
▸ LOXL2 Q9Y4K0 1/20 0.46
▸ PRMT1 Q99873 3/20 0.43
▸ MAOB P27338 1/20 0.42
▸ ACKR3 P25106 2/20 0.42
▸ TMEM97 Q5BJF2 1/20 0.42
▸ SIGMAR1 Q99720 1/20 0.42
▸ KDM4E B2RXH2 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL13989609 0.87 PYCR1 (0.50) CARM1PRMT6PRMT8PYCR1AOC3
Hydrochloric Acid SCHEMBL31687514 0.87 PYCR1 (0.50) CARM1PRMT6PRMT8PYCR1AOC3
Hydrochloric Acid SCHEMBL4605377 0.85 PYCR1 (0.49) CARM1PRMT6PRMT8PYCR1AOC3
SCHEMBL3191532 0.83 PYCR1 (0.67) PYCR1AOC3TAAR1LOXL2KDM4E
SCHEMBL30093198 0.83 PYCR1 (0.67) PYCR1AOC3TAAR1LOXL2KDM4E
SCHEMBL13889677 0.82 TAAR1 (0.61) CARM1PRMT6PRMT8PYCR1AOC3
SCHEMBL10051134 0.82 CARM1 (0.68) CARM1PRMT6PRMT8PYCR1TAAR1
SCHEMBL15308539 0.82 PYCR1 (0.56) CARM1PRMT6PRMT8PYCR1AOC3
SCHEMBL19615965 0.80 PYCR1 (0.55) CARM1PRMT6PRMT8PYCR1AOC3
SCHEMBL9826270 0.80 PYCR1 (0.55) CARM1PRMT6PRMT8PYCR1AOC3

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-3845276-A1 SS-AMINO ACID DERIVATIVE, KINASE INHIBITOR AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME, AND USE OF THE SAME Industrial Technology Research Institute (TW) 2021-07-07 — — EP disclosed
Send feedback