SCHEMBL7103365

SCHEMBL7103365

NC(=Nc1ccc(Cl)cc1Cl)N1CCc2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.54
TDP1 Q9NUW8 1/20 0.54
SMN1; SMN2 Q16637 4/20 0.51
NPC1 O15118 3/20 0.51
RAB9A P51151 3/20 0.51
SIGMAR1 Q99720 2/20 0.51
SPR P35270 1/20 0.48
SCN2A Q99250 1/20 0.44
ITGB3 P05106 1/20 0.43
ITGAV P06756 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
TP53 P04637 2/20 0.43
ALDH1A1 P00352 1/20 0.43
CDK4 P11802 1/20 0.42
CCND1 P24385 1/20 0.42
POLB P06746 1/20 0.42
TSHR P16473 1/20 0.42
LMNA P02545 1/20 0.42

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
SCHEMBL6775304 0.90 MAPT (0.54) MAPTTDP1SMN1; SMN2NPC1RAB9A
SCHEMBL6774952 0.87 MAPT (0.55) MAPTTDP1SMN1; SMN2NPC1RAB9A
SCHEMBL7106343 0.83 MAPT (0.58) MAPTTDP1SMN1; SMN2NPC1RAB9A
SCHEMBL6770333 0.82 GPBAR1 (0.49) MAPTTDP1SMN1; SMN2SIGMAR1SPR
SCHEMBL6776139 0.82 MAPT (0.56) MAPTTDP1SMN1; SMN2NPC1RAB9A
SCHEMBL7100143 0.81 SIGMAR1 (0.58) MAPTTDP1SMN1; SMN2NPC1RAB9A
SCHEMBL7106082 0.80 SIGMAR1 (0.60) MAPTTDP1SMN1; SMN2NPC1RAB9A
SCHEMBL7104957 0.79 SIGMAR1 (0.50) MAPTTDP1SMN1; SMN2SIGMAR1SPR
SCHEMBL6765703 0.78 SIGMAR1 (0.61) MAPTTDP1SMN1; SMN2NPC1RAB9A
SCHEMBL7104919 0.77 MAPT (0.54) MAPTTDP1SMN1; SMN2NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030153763-A1 Pharmaceutically active compounds and methods of use WYETH 2003-08-14 US claimed
US-20020099084-A1 Pharmaceutically active compounds and methods of use WYETH 2002-07-25 US claimed
EP-0925300-A4 1999-06-30 EP claimed
EP-0925300-A1 PHARMACEUTICALLY ACTIVE COMPOUNDS AND METHODS OF USE CAMBRIDGE NEUROSCIENCE, INC. (US) 1999-06-30 EP claimed
WO-1997030054-A1 PHARMACEUTICALLY ACTIVE COMPOUNDS AND METHODS OF USE CAMBRIDGE NEUROSCIENCE, INC. (US) 1997-08-21 WO claimed
WO-1999002145-A1 COMBINATION DRUG THERAPIES COMPRISING AMINOGLYCOSIDE ANTIBIOTICS AND N,N'-DISUBSTITUTED GUANIDINES CAMBRIDGE NEUROSCIENCE, INC. (US) 1999-01-21 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 (2 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-20030153763-A1 Pharmaceutically active compounds and methods of use ACHE, PARK7, NLN MAPT 122/4885TDP1 297/4885SMN1; SMN2 104/4885
US-20020099084-A1 Pharmaceutically active compounds and methods of use ACHE, PARK7, NLN MAPT 122/4885TDP1 297/4885SMN1; SMN2 104/4885

“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.