SCHEMBL5008976

SCHEMBL5008976

CN1CC=C(c2cccc3[nH]ccc23)CC1

nearest known ligand 0.68

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 8/20 0.68
HTR1A P08908 2/20 0.68
KDM4E B2RXH2 1/20 0.68
LMNA P02545 1/20 0.68
POLB P06746 1/20 0.68
ALOX15 P16050 1/20 0.68
HTR6 P50406 1/20 0.68
HSD17B10 Q99714 1/20 0.68
L3MBTL1 Q9Y468 1/20 0.68

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
Fumaric Acid SCHEMBL10674120 0.89 SLC6A4 (0.56) SLC6A4HTR1AKDM4ELMNAPOLB
SCHEMBL10671532 0.83 HTR1A (0.59) SLC6A4HTR1AKDM4ELMNAPOLB
SCHEMBL10674565 0.82 KDM4E (0.70) SLC6A4HTR1AKDM4ELMNAPOLB
Hydrochloric Acid SCHEMBL11439099 0.81 SLC6A4 (1.00) SLC6A4HTR1AKDM4ELMNAPOLB
SCHEMBL4674658 0.81 SLC6A4 (1.00) SLC6A4HTR1AKDM4ELMNAPOLB
SCHEMBL10672260 0.81 HTR1A (0.57) SLC6A4HTR1AKDM4ELMNAALOX15
SCHEMBL20740133 0.79 MAPT (0.47) SLC6A4HTR1AKDM4ELMNAPOLB
SCHEMBL11228410 0.78 HTR2A (0.54) HTR6
SCHEMBL7648302 0.78 MAPT (0.53) SLC6A4HTR1AKDM4ELMNAPOLB
SCHEMBL3673755 0.78 SLC6A4 (0.54) SLC6A4HTR1AKDM4ELMNAPOLB

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
US-20080318941-A1 4' SUBSTITUTED COMPOUNDS HAVING 5-HT6 RECEPTOR AFFINITY MEMORY PHARMACEUTICALS CORPORATION (US) 2008-12-25 US disclosed
US-4737505-A Analgesic 4-substituted indoles ROUSSEL UCLAF (FR) 1988-04-12 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-20080318941-A1 4' SUBSTITUTED COMPOUNDS HAVING 5-HT6 RECEPTOR AFFINITY HTR6, HTR1B, HTR3B SLC6A4 19/4885HTR1A 5/4885KDM4E 1481/4885

“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.