SCHEMBL6846185

SCHEMBL6846185

Clc1ccc(OC[C@H]2C3CCC(C[C@@H]2CC2CCCCCC2)N3)cc1Cl

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.37
PARP15 Q460N3 2/20 0.36
PARP10 Q53GL7 2/20 0.36
SLC6A3 Q01959 2/20 0.35
SLC6A4 P31645 1/20 0.35
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
BCL2L1 Q07817 1/20 0.33
MCL1 Q07820 1/20 0.33
PTGER2 P43116 1/20 0.33
HSP90AA1 P07900 1/20 0.33
HSP90AB1 P08238 1/20 0.33

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
SCHEMBL6846186 1.00 HPGD (0.37) HPGDPARP15PARP10SLC6A3SLC6A4
SCHEMBL6839637 0.84 SLC6A3 (0.36) HPGDSLC6A3SLC6A4HSP90AA1HSP90AB1
SCHEMBL6839640 0.84 SLC6A3 (0.36) HPGDSLC6A3SLC6A4HSP90AA1HSP90AB1
SCHEMBL7328555 0.67 KDM4E (0.46) HPGDSLC6A3SLC6A4
SCHEMBL3249653 0.64 SLC6A2 (0.63) SLC6A3SLC6A4HSP90AA1HSP90AB1
SCHEMBL5675511 0.63 HPGD (0.48) HPGDPARP15PARP10MAOAMAOB
SCHEMBL14312068 0.63 SLC6A2 (0.57) SLC6A3SLC6A4
SCHEMBL4433623 0.63 SLC6A3 (0.61) HPGDSLC6A3SLC6A4
SCHEMBL3587139 0.63 SLC6A3 (0.61) HPGDSLC6A3SLC6A4
SCHEMBL12313096 0.63 SLC6A3 (0.61) HPGDSLC6A3SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040235906-A1 Substituted amine derivatives and their use as monoamine neurotransmitter re-up-take inhibitors NEUROSEARCH A/S (DK) 2004-11-25 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-20040235906-A1 Substituted amine derivatives and their use as monoamine neurotransmitter re-up-take inhibitors SLC6A2, SLC18A2, MAOB HPGD 996/4885PARP15 1953/4885PARP10 1959/4885

“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.