SCHEMBL6496932

SCHEMBL6496932

Cc1ccc(C(=O)NC2CC3CNC2C3)s1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.49
RAB9A P51151 6/20 0.49
TAS1R3 Q7RTX0 2/20 0.42
TAS1R1 Q7RTX1 2/20 0.42
F10 P00742 1/20 0.41
SMN1; SMN2 Q16637 4/20 0.40
KMT2A Q03164 3/20 0.40
ALDH1A1 P00352 2/20 0.40
POLB P06746 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
DAO P14920 1/20 0.38
MEN1 O00255 2/20 0.38
USP2 O75604 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL6498845 0.84 ALDH1A1 (0.51) NPC1RAB9ASMN1; SMN2KMT2AALDH1A1
SCHEMBL6501183 0.84 F10 (0.46) RAB9AF10SMN1; SMN2KMT2AMEN1
SCHEMBL6486663 0.83 ESRRG (0.46) NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL6498394 0.81 HPGD (0.48)
SCHEMBL6497432 0.80 CHRNA7 (0.54) NPC1RAB9ASMN1; SMN2KMT2AALDH1A1
SCHEMBL6487853 0.80 RXFP1 (0.47) NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL6488299 0.79 ESRRG (0.55)
SCHEMBL6498807 0.78 MAPK11 (0.43) NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL6497200 0.78 KDM4E (0.51) NPC1RAB9ASMN1; SMN2KMT2AALDH1A1
SCHEMBL6489244 0.78 ESRRG (0.46) NPC1RAB9AKMT2AALDH1A1

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 NPC1 224/4885RAB9A 1437/4885TAS1R3 4638/4885

“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.