SCHEMBL22305405

SCHEMBL22305405

c1ccc(CCCCC(c2ccccc2)N2CCNCC2)cc1

nearest known ligand 0.81

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 18/20 0.81
SLC6A2 P23975 13/20 0.66
SLC6A3 Q01959 6/20 0.55
SIGMAR1 Q99720 1/20 0.53
CYP1A2 P05177 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50

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
SCHEMBL11801805 0.95 SLC6A4 (0.83) SLC6A4SLC6A2SLC6A3SIGMAR1CYP1A2
SCHEMBL5444533 0.89 SLC6A4 (1.00) SLC6A4SLC6A2SLC6A3CYP1A2CYP2D6
SCHEMBL12806751 0.84 SLC6A4 (0.64) SLC6A4SLC6A2SLC6A3CYP1A2CYP2D6
SCHEMBL12806778 0.82 SLC6A4 (0.66) SLC6A4SLC6A2SLC6A3CYP1A2CYP2D6
SCHEMBL20804351 0.81 CCR3 (0.59) SLC6A4SIGMAR1MEN1KMT2A
SCHEMBL26358361 0.80 SLC6A4 (0.52) SLC6A4SLC6A2SLC6A3SIGMAR1CYP1A2
SCHEMBL6171525 0.80 SLC6A4 (1.00) SLC6A4SLC6A2SLC6A3CYP1A2CYP2D6
SCHEMBL5915354 0.79 SLC6A4 (0.62) SLC6A4SLC6A2SLC6A3SIGMAR1CYP2D6
SCHEMBL9816200 0.78 SLC6A4 (0.69) SLC6A4SLC6A2SLC6A3CYP1A2CYP2D6
SCHEMBL10413788 0.78 SLC6A4 (0.69) SLC6A4SLC6A2SLC6A3CYP1A2CYP2D6

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-20230302030-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND USE THEREOF AS INHIBITORS OF RAN GTPase CENTRE HOSPITALIER DE L'UNIVERSITE DE MONTREAL (CA) 2023-09-28 US disclosed
US-20200246365-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND USE THEREOF AS INHIBITORS OF RAN GTPASE CENTRE HOSPITALIER DE L'UNIVERSITÉ DE MONTRÉAL (CA) 2020-08-06 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 (2 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-20200246365-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND USE THEREOF AS INHIBITORS OF RAN GTPASE RAN, RANBP1, GDI2 SLC6A4 2520/4885SLC6A2 2795/4885SLC6A3 2755/4885
US-20230302030-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND USE THEREOF AS INHIBITORS OF RAN GTPase RAN, RANBP1, GDI2 SLC6A4 2520/4885SLC6A2 2795/4885SLC6A3 2755/4885

“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.