SCHEMBL6502115

SCHEMBL6502115

CC1CC2CCN1C[C@@H]2NC(=O)c1ccc(-c2ccccc2Cl)o1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 12/20 0.52
NPC1 O15118 8/20 0.52
CASP3 P42574 4/20 0.51
SENP7 Q9BQF6 4/20 0.51
SENP6 Q9GZR1 3/20 0.51
SENP8 Q96LD8 2/20 0.51
LMNA P02545 4/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
MAPT P10636 3/20 0.49
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
MAPK1 P28482 2/20 0.49
RECQL P46063 1/20 0.49
NPSR1 Q6W5P4 2/20 0.48
GAA P10253 1/20 0.48
HTT P42858 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
ALDH1A1 P00352 3/20 0.47
MAPKAPK2 P49137 1/20 0.46
HPGD P15428 2/20 0.44

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
SCHEMBL6632514 1.00 RAB9A (0.52) RAB9ANPC1CASP3SENP7SENP6
SCHEMBL6496106 0.89 CHRNA7 (0.44) RAB9ANPC1CASP3SENP7SENP6
SCHEMBL6488495 0.89 ALDH1A1 (0.46) RAB9ANPC1CASP3SENP7SENP6
SCHEMBL6492376 0.88 RAB9A (0.48) RAB9ANPC1CASP3SENP7SENP6
SCHEMBL6490697 0.88 CHRNA7 (0.43) RAB9ANPC1CASP3SENP7SENP6
SCHEMBL6487870 0.87 CHRNA7 (0.53) RAB9ANPC1SMN1; SMN2MAPTTDP1
SCHEMBL6497753 0.86 ALDH1A1 (0.52) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL6491301 0.86 SMN1; SMN2 (0.44) RAB9ANPC1CASP3SENP7SENP6
SCHEMBL6499492 0.84 NPC1 (0.54) RAB9ANPC1LMNASMN1; SMN2MAPT
SCHEMBL6490047 0.84 HDAC1 (0.44) RAB9ANPC1CASP3SENP7SENP6

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 RAB9A 1437/4885NPC1 224/4885CASP3 4118/4885

“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.