SCHEMBL4200225

SCHEMBL4200225

O=C(O)N1CCc2cc(Cl)c(N3CCC(F)CC3)nc2CC1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
GPR6 P46095 13/20 0.35
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
GRM5 P41594 1/20 0.33
HSP90AB1 P08238 2/20 0.32
HSP90AA1 P07900 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 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
SCHEMBL4204506 0.86 NPSR1 (0.38) SMN1; SMN2GAAMAPTHSP90AA1NPC1
SCHEMBL4009886 0.86 FABP3 (0.37) SMN1; SMN2GAAMAPTCYP2C9HSP90AB1
SCHEMBL4204508 0.84 WHR1 (0.35) GRM5HSP90AB1HSP90AA1NPC1RAB9A
SCHEMBL4014837 0.77 HTR6 (0.36) LMNASMN1; SMN2
Hydrochloric Acid SCHEMBL4212997 0.76 HTR6 (0.36)
SCHEMBL8044950 0.71 USP2 (0.47) SMN1; SMN2MAPT
SCHEMBL8057043 0.69 MAPT (0.42) MAPT
SCHEMBL4214586 0.68 USP2 (0.43) SMN1; SMN2MAPT
SCHEMBL28745137 0.66 KEAP1 (0.41) SMN1; SMN2GRM5HSP90AB1HSP90AA1
SCHEMBL27931611 0.65 NCF1 (0.36) LMNASMN1; SMN2MAPTCYP2C19NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090312306-A1 TETRAHYDRO-5H-PYRIDO[2,3-D]AZEPINES AS 5-HT2C LIGANDS CASCADE THERAPEUTICS INC. (CA) 2009-12-17 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-20090312306-A1 TETRAHYDRO-5H-PYRIDO[2,3-D]AZEPINES AS 5-HT2C LIGANDS HTR2C, HTR2A, HTR5A LMNA 3569/4885SMN1; SMN2 965/4885GPR6 215/4885

“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.