SCHEMBL19430304

SCHEMBL19430304

CC(C)N1NCc2c(C(=O)N(C)Cc3cccc(F)c3)cc(-c3cccc(CN(C)CCN)c3)nc21

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ SCD5 Q86SK9 1/20 0.39
▸ AOC3 Q16853 4/20 0.38
▸ HSD17B1 P14061 2/20 0.36
▸ HSD17B2 P37059 2/20 0.36
▸ LIPE Q05469 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ CLK1 P49759 1/20 0.35
▸ CLK2 P49760 1/20 0.35
▸ DYRK1A Q13627 1/20 0.35
▸ CLK4 Q9HAZ1 1/20 0.35
▸ DYRK1B Q9Y463 1/20 0.35
▸ ACKR3 P25106 1/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ TRPV3 Q8NET8 1/20 0.34
▸ RIPK1 Q13546 1/20 0.33
▸ EZH2 Q15910 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
SCHEMBL19430078 0.95 AOC3 (0.38) SCD5AOC3HSD17B1HSD17B2ALDH1A1
SCHEMBL19430265 0.91 AOC3 (0.37) AOC3LIPEALDH1A1ACKR3MEN1
SCHEMBL19429870 0.91 AOC3 (0.39) AOC3ALDH1A1TRPV3RIPK1
SCHEMBL19430262 0.89 AOC3 (0.37) AOC3CLK1
SCHEMBL19430208 0.89 ACKR3 (0.39) AOC3ACKR3MEN1KMT2A
SCHEMBL19430290 0.87 AOC3 (0.36) AOC3ALDH1A1KMT2AEZH2
SCHEMBL19429847 0.85 HTT (0.37) AOC3ACKR3
SCHEMBL19429839 0.85 AOC3 (0.39) AOC3
SCHEMBL19430087 0.84 AOC3 (0.42) AOC3
SCHEMBL19430282 0.84 AOC3 (0.43) AOC3TRPV3

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-20170280720-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2017-10-05 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170280720-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF PRMT1, PRMT3, PRMT5 SCD5 1907/4885AOC3 2654/4885HSD17B1 920/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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