SCHEMBL6487262

SCHEMBL6487262

CC1CC2CCN1C[C@@H]2NC(=O)c1ncc(-c2ccc(NC(=O)C(F)(F)F)cc2)s1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 13/20 0.42
USP30 Q70CQ3 1/20 0.42
MEN1 O00255 2/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
KMT2A Q03164 2/20 0.42
CHRNA7 P36544 3/20 0.37
HSP90AA1 P07900 1/20 0.36
PAX8 Q06710 1/20 0.36
WNT3A P56704 1/20 0.35
HTR3E A5X5Y0 1/20 0.35
HTR3B O95264 1/20 0.35
HTR3A P46098 1/20 0.35
HTR3D Q70Z44 1/20 0.35
HTR3C Q8WXA8 1/20 0.35

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
SCHEMBL6487985 0.92 NPC1 (0.45) DGAT1USP30MEN1NPC1RAB9A
SCHEMBL6499364 0.89 DGAT1 (0.45) DGAT1USP30CHRNA7HTR3EHTR3B
SCHEMBL6487532 0.87 USP30 (0.46) DGAT1USP30CHRNA7HTR3EHTR3B
SCHEMBL6489485 0.86 USP30 (0.47) DGAT1USP30CHRNA7HTR3EHTR3B
SCHEMBL6489552 0.86 USP30 (0.47) DGAT1USP30CHRNA7HTR3EHTR3B
SCHEMBL6499162 0.86 CHRNA7 (0.50) MEN1NPC1RAB9AKMT2ACHRNA7
SCHEMBL6495239 0.85 USP30 (0.39) DGAT1USP30CHRNA7HTR3EHTR3B
SCHEMBL6500798 0.85 USP30 (0.46) DGAT1USP30CHRNA7HTR3EHTR3B
SCHEMBL6488284 0.85 USP30 (0.46) DGAT1USP30CHRNA7HTR3EHTR3B
SCHEMBL6496913 0.85 USP30 (0.57) DGAT1USP30CHRNA7HTR3EHTR3B

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 8 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
EP-1442041-A1 AZABICYCLIC-SUBSTITUTED-HETEROARYL COMPOUNDS FOR THE TREATMENT OF DISEASE PHARMACIA & UPJOHN COMPANY (US) 2004-08-04 EP claimed
US-20030207913-A1 Azabicyclic-substituted-heteroaryl compounds for the treatment of disease PHARMACIA & UPJOHN COMPANY 2003-11-06 US claimed
WO-2003040147-A1 AZABICYCLIC-SUBSTITUTED-HETEROARYL COMPOUNDS FOR THE TREATMENT OF DISEASE__________________________________________________________________________________________________________________________ PHARMACIA & UPJOHN COMPANY (US) 2003-05-15 WO claimed
US-6919359-B2 Azabicyclic-substituted-heteroaryl compounds for the treatment of disease PFIZER INC (US) 2005-07-19 US disclosed
EP-1442041-A1 AZABICYCLIC-SUBSTITUTED-HETEROARYL COMPOUNDS FOR THE TREATMENT OF DISEASE PHARMACIA & UPJOHN COMPANY (US) 2004-08-04 EP disclosed
US-20030207913-A1 Azabicyclic-substituted-heteroaryl compounds for the treatment of disease PHARMACIA & UPJOHN COMPANY 2003-11-06 US disclosed
WO-2003040147-A1 AZABICYCLIC-SUBSTITUTED-HETEROARYL COMPOUNDS FOR THE TREATMENT OF DISEASE__________________________________________________________________________________________________________________________ PHARMACIA & UPJOHN COMPANY (US) 2003-05-15 WO 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 DGAT1 2495/4885USP30 3442/4885MEN1 1004/4885

“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.