SCHEMBL5420274

SCHEMBL5420274

CCC(=O)NCCCN1CCC(N2CCc3cnc(O)c4cccc2c34)CC1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.42
DRD3 P35462 2/20 0.42
MTNR1A P48039 3/20 0.37
LMNA P02545 2/20 0.37
MTNR1B P49286 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
GSK3B P49841 1/20 0.37
CYP2D6 P10635 1/20 0.36
CHRM1 P11229 2/20 0.36
KMT2A Q03164 1/20 0.36
KDM4E B2RXH2 1/20 0.35
TP53 P04637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TSHR P16473 1/20 0.35
ACHE P22303 1/20 0.35

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
SCHEMBL5412845 0.95 DRD2 (0.39) DRD2DRD3MTNR1AMTNR1B
SCHEMBL5414913 0.95 MTNR1A (0.41) DRD2DRD3MTNR1AMTNR1BCHRM1
SCHEMBL5410131 0.91 CYP2D6 (0.37) MTNR1AMTNR1BCYP2D6KDM4EHSD17B10
SCHEMBL5419231 0.90 MTNR1A (0.39) DRD2DRD3MTNR1AMTNR1B
SCHEMBL5407123 0.87 DRD2 (0.35) DRD2DRD3SMN1; SMN2CYP2D6CHRM1
SCHEMBL5425381 0.86 CCR3 (0.38) DRD2DRD3
SCHEMBL5412618 0.86 MTNR1A (0.39) DRD2MTNR1AKDM4E
SCHEMBL5415255 0.84 DRD2 (0.43) DRD2DRD3MTNR1ALMNAMTNR1B
SCHEMBL5425324 0.84 CARM1 (0.38)
SCHEMBL5428066 0.83 NOS3 (0.36) DRD2DRD3LMNACHRM1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7160894-B2 Antagonist of phosphorylation of myosin regulatory light chain, enzyme inhibitors; therapeutic treatment of glaucoma, bronchial asthma, chronic obstructive pulmonary disease, nervous system disorders; 4-(2,3-dihydro-1,5-diazaphenalen-1-yl)cyclohexylamine ASAHI KASEI PHARMA CORPORATION (JP) 2007-01-09 US claimed
EP-1632492-A1 TRICYCLIC COMPOUND Asahi Kasei Pharma Corporation (JP) 2006-03-08 EP claimed
US-20050096310-A1 Tricyclic compound ASAHI KASEI PHARMA CORPORATION (JP) 2005-05-05 US claimed

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-20050096310-A1 Tricyclic compound MYLK3, CSNK1A1L, MYLK DRD2 2064/4885DRD3 1030/4885MTNR1A 527/4885

“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.