SCHEMBL6489430

SCHEMBL6489430

Cc1cnc(C(=O)NC2CC3CC2CN3)s1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMYD3 Q9H7B4 3/20 0.50
DPP4 P27487 1/20 0.35
HDAC3 O15379 2/20 0.35
HDAC1 Q13547 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
NPC1 O15118 4/20 0.34
RAB9A P51151 4/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
GAA P10253 1/20 0.34
USP30 Q70CQ3 1/20 0.34
CHRNA7 P36544 2/20 0.34
PKM P14618 1/20 0.33
EPHX2 P34913 1/20 0.33
F12 P00748 2/20 0.33
IRAK4 Q9NWZ3 1/20 0.33
POLB P06746 1/20 0.32

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
SCHEMBL6488734 0.85 CCNE1 (0.35) SMYD3SMN1; SMN2USP30
SCHEMBL6496323 0.85 CHRNB2 (0.37) SMYD3USP30CHRNA7IRAK4
SCHEMBL6498247 0.83 USP30 (0.45) SMYD3HDAC1USP30
SCHEMBL6498058 0.82 USP30 (0.40) SMYD3HDAC3HDAC1KMT2AUSP30
SCHEMBL6489724 0.81 USP30 (0.53) HDAC1USP30CHRNA7
SCHEMBL6500135 0.80 HDAC6 (0.49) HDAC1NPC1RAB9AUSP30IRAK4
SCHEMBL6495134 0.79 USP30 (0.44) HDAC1USP30
SCHEMBL6500073 0.78 NPC1 (0.49) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL6490465 0.78 HDAC6 (0.45) HDAC1USP30
SCHEMBL6490254 0.78 USP30 (0.43) HDAC1USP30

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6919359-B2 Azabicyclic-substituted-heteroaryl compounds for the treatment of disease PFIZER INC (US) 2005-07-19 US claimed
US-20030207913-A1 Azabicyclic-substituted-heteroaryl compounds for the treatment of disease PHARMACIA & UPJOHN COMPANY 2003-11-06 US claimed
US-6919359-B2 Azabicyclic-substituted-heteroaryl compounds for the treatment of disease PFIZER INC (US) 2005-07-19 US disclosed
US-20030207913-A1 Azabicyclic-substituted-heteroaryl compounds for the treatment of disease PHARMACIA & UPJOHN COMPANY 2003-11-06 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-20030207913-A1 Azabicyclic-substituted-heteroaryl compounds for the treatment of disease MALT1, WFS1, NR5A1 SMYD3 4646/4885DPP4 3213/4885HDAC3 1855/4885

“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.