SCHEMBL13800970

SCHEMBL13800970

CSc1cccc(CN2CCCC2)c1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PRMT6 Q96LA8 1/20 0.57
▸ ALDH1A1 P00352 4/20 0.56
▸ SMN1; SMN2 Q16637 3/20 0.56
▸ TDP1 Q9NUW8 1/20 0.56
▸ KMT2A Q03164 3/20 0.53
▸ MEN1 O00255 2/20 0.53
▸ MAPT P10636 2/20 0.53
▸ GAA P10253 2/20 0.51
▸ KDM4E B2RXH2 2/20 0.51
▸ LMNA P02545 2/20 0.51
▸ NPSR1 Q6W5P4 1/20 0.51
▸ CYP2D6 P10635 1/20 0.50
▸ CYP2C9 P11712 1/20 0.50
▸ HIF1A Q16665 1/20 0.50
▸ NPC1 O15118 1/20 0.49

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
SCHEMBL13574521 0.98 ALDH1A1 (0.58) PRMT6ALDH1A1SMN1; SMN2TDP1KMT2A
SCHEMBL24233058 0.85 NCF1 (0.60) ALDH1A1SMN1; SMN2KMT2AMEN1GAA
SCHEMBL7813992 0.81 SMN1; SMN2 (0.54) PRMT6ALDH1A1SMN1; SMN2TDP1GAA
SCHEMBL7805242 0.80 SMN1; SMN2 (0.53) PRMT6ALDH1A1SMN1; SMN2TDP1GAA
SCHEMBL11339852 0.79 PRMT6 (0.78) PRMT6ALDH1A1SMN1; SMN2TDP1GAA
SCHEMBL11192726 0.79 PRMT6 (0.78) PRMT6ALDH1A1SMN1; SMN2TDP1GAA
SCHEMBL7813997 0.79 SMN1; SMN2 (0.55) PRMT6ALDH1A1SMN1; SMN2TDP1GAA
SCHEMBL7805238 0.79 SMN1; SMN2 (0.51) PRMT6ALDH1A1SMN1; SMN2TDP1GAA
SCHEMBL24093249 0.78 ALDH1A1 (0.61) PRMT6ALDH1A1SMN1; SMN2TDP1GAA
SCHEMBL12622771 0.77 PRMT6 (0.68) PRMT6ALDH1A1SMN1; SMN2TDP1GAA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090156642-A1 5-Membered heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-06-18 — — US disclosed
US-20090156642-A1 5-Membered heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-06-18 — — 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-20090156642-A1 5-Membered heterocyclic compound CEL, PGA5, COG5 PRMT6 4420/4885ALDH1A1 1497/4885SMN1; SMN2 4327/4885

“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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