SCHEMBL5597231

SCHEMBL5597231

CC(=O)NC1CCC(N2CCc3cnc(O)c4cccc2c34)CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.38
JAK2 O60674 1/20 0.37
JAK1 P23458 1/20 0.37
CKS1B P61024 1/20 0.36
SKP1 P63208 1/20 0.36
SKP2 Q13309 1/20 0.36
MTNR1A P48039 3/20 0.35
MTNR1B P49286 3/20 0.35
HSD11B1 P28845 1/20 0.35
SCD O00767 2/20 0.35
MEN1 O00255 1/20 0.35
POLB P06746 1/20 0.35
TSHR P16473 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
OPRM1 P35372 1/20 0.34

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
SCHEMBL5420136 0.87 NOS1 (0.41) SCDOPRM1OPRD1OPRK1OPRL1
SCHEMBL5596973 0.85 JAK1 (0.37) JAK2JAK1MEN1TSHRKMT2A
SCHEMBL5412618 0.84 MTNR1A (0.39) DRD2JAK1MTNR1AKDM4EALDH1A1
SCHEMBL5930878 0.83
SCHEMBL5417025 0.83 CARM1 (0.33) OPRM1OPRD1OPRK1OPRL1
SCHEMBL5596783 0.82 SCN9A (0.36) DRD2SCDKDM4EOPRM1OPRD1
SCHEMBL5596400 0.82 KDM1A (0.32) OPRM1OPRD1OPRK1OPRL1
SCHEMBL5416466 0.82 HCK (0.38) MEN1POLBKMT2AKDM4EALDH1A1
SCHEMBL5410131 0.82 CYP2D6 (0.37) MTNR1AMTNR1BKDM4E
SCHEMBL5930902 0.82

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1829876-A1 NITROGENEOUS TRICYCLIC COMPOUND Asahi Kasei Pharma Corporation (JP) 2007-09-05 EP disclosed
US-20060247266-A1 Nitrogen-containing tricyclic compounds ASAHI KASEI PHARMA CORPORATION (JP) 2006-11-02 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-20060247266-A1 Nitrogen-containing tricyclic compounds MYO1B, CHRM1, MYL12A DRD2 1473/4885JAK2 1211/4885JAK1 565/4885

“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.