SCHEMBL428468

SCHEMBL428468

Cc1nnc(-c2cc3c(N4CCN(C(=O)OC(C)(C)C)CC4)cccc3o2)o1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 2/20 0.46
BACE1 P56817 4/20 0.43
SMARCA2 P51531 1/20 0.43
SMARCA4 P51532 1/20 0.43
PBRM1 Q86U86 1/20 0.43
TBK1 Q9UHD2 1/20 0.40
PIK3CA P42336 1/20 0.39
KIT P10721 1/20 0.39
KDM1A O60341 1/20 0.39
CKS1B P61024 1/20 0.38
SKP1 P63208 1/20 0.38
SKP2 Q13309 1/20 0.38
MAPT P10636 2/20 0.38
MEN1 O00255 1/20 0.38
TSHR P16473 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
GLA P06280 1/20 0.38
NAMPT P43490 1/20 0.38
SMPD3 Q9NY59 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
SCHEMBL10268226 0.87 GLA (0.37) MAPTMEN1KMT2ASMN1; SMN2GLA
SCHEMBL15985793 0.77 BACE1 (0.47) GPR119BACE1SMARCA2SMARCA4PBRM1
SCHEMBL10069100 0.76 BACE1 (0.49) BACE1MAPTSMN1; SMN2ALDH1A1
SCHEMBL30725419 0.76 BACE1 (0.49) BACE1MAPTSMN1; SMN2ALDH1A1
SCHEMBL10068249 0.76 BACE1 (0.57) BACE1SMARCA2SMARCA4PBRM1KIT
SCHEMBL15985821 0.73 ALDH1A1 (0.45) GPR119BACE1SMARCA2SMARCA4PBRM1
SCHEMBL28494385 0.73 GPR119 (0.48) GPR119SMARCA2SMARCA4PBRM1TBK1
SCHEMBL16569704 0.72 SMN1; SMN2 (0.47) GPR119SMARCA2SMARCA4PBRM1CKS1B
SCHEMBL30223187 0.70 NR1H2 (0.52) GPR119TBK1KITCKS1BSKP1
SCHEMBL4558301 0.70 BACE1 (0.59) GPR119BACE1SMARCA2SMARCA4PBRM1

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-20120022056-A1 FUSED TRICYCLIC DERIVATIVES FOR THE TREATMENT OF PSYCHOTIC DISORDERS BENTLEY JONATHAN (IT) 2012-01-26 US disclosed
US-20120022056-A1 FUSED TRICYCLIC DERIVATIVES FOR THE TREATMENT OF PSYCHOTIC DISORDERS BENTLEY JONATHAN (IT) 2012-01-26 US disclosed
EP-1786822-A1 FUSED TRICYCLIC DERIVATIVES FOR THE TREATMENT OF PSYCHOTIC DISORDERS GLAXO GROUP LIMITED (GB) 2007-05-23 EP disclosed
WO-2006024517-A1 FUSED TRICYCLIC DERIVATIVES FOR THE TREATMENT OF PSYCHOTIC DISORDERS GLAXO GROUP LIMITED (GB) 2006-03-09 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-20120022056-A1 FUSED TRICYCLIC DERIVATIVES FOR THE TREATMENT OF PSYCHOTIC DISORDERS GABBR1, GABRQ, GABRE GPR119 430/4885BACE1 705/4885SMARCA2 3246/4885

“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.