SCHEMBL5757587

SCHEMBL5757587

C[C@H]1C[C@@H](c2ccc3ccccc3c2)CCN1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 11/20 0.46
DRD2 P14416 1/20 0.46
SLC6A2 P23975 7/20 0.45
SLC6A3 Q01959 7/20 0.45
CYP2D6 P10635 1/20 0.45
KCNH2 Q12809 1/20 0.45
KDM1A O60341 2/20 0.43
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
PLG P00747 1/20 0.41
HTR2C P28335 1/20 0.40
HTR2B P41595 1/20 0.40
KDM4E B2RXH2 1/20 0.39
P2RY14 Q15391 1/20 0.38

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
SCHEMBL7123942 1.00 SLC6A4 (0.46) SLC6A4DRD2SLC6A2SLC6A3CYP2D6
SCHEMBL5756712 1.00 SLC6A4 (0.46) SLC6A4DRD2SLC6A2SLC6A3CYP2D6
SCHEMBL5090671 1.00 SLC6A4 (0.46) SLC6A4DRD2SLC6A2SLC6A3CYP2D6
SCHEMBL7968422 1.00 SLC6A4 (0.46) SLC6A4DRD2SLC6A2SLC6A3CYP2D6
SCHEMBL5757581 1.00 SLC6A4 (0.46) SLC6A4DRD2SLC6A2SLC6A3CYP2D6
SCHEMBL7968432 1.00 SLC6A4 (0.46) SLC6A4DRD2SLC6A2SLC6A3CYP2D6
SCHEMBL5758612 0.83 SLC6A2 (0.47) SLC6A4SLC6A2SLC6A3KDM1AMAOA
SCHEMBL5758608 0.83 SLC6A2 (0.47) SLC6A4SLC6A2SLC6A3KDM1AMAOA
SCHEMBL7970364 0.83 SLC6A2 (0.47) SLC6A4SLC6A2SLC6A3KDM1AMAOA
SCHEMBL5757803 0.83 SLC6A2 (0.47) SLC6A4SLC6A2SLC6A3KDM1AMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7144898-B2 Indole derivatives for the treatment of depression and anxiety ELI LILLY AND COMPANY (US) 2006-12-05 US disclosed
EP-1242411-B1 INDOLE DERIVATIVES FOR THE TREATMENT OF DEPRESSION AND ANXIETY LILLY CO ELI (US) 2006-03-08 EP disclosed
US-20040006229-A1 Indole derivatives for the treatment of depression and anxiety ELI LILLY AND COMPANY 2004-01-08 US disclosed
EP-1242411-A1 INDOLE DERIVATIVES FOR THE TREATMENT OF DEPRESSION AND ANXIETY ELI LILLY AND COMPANY (US) 2002-09-25 EP disclosed
US-6303627-B1 FOR THERAPY OF PHYSIOLOGICAL AND PSYCHOLOGICAL DISORDERS ELI LILLY AND COMPANY 2001-10-16 US disclosed
WO-2001046181-A1 INDOLE DERIVATIVES FOR THE TREATMENT OF DEPRESSION AND ANXIETY ELI LILLY AND COMPANY (US) 2001-06-28 WO disclosed
WO-1999065487-A1 INHIBITORS OF SEROTONIN REUPTAKE ELI LILLY AND COMPANY (US) 1999-12-23 WO disclosed
EP-0965587-A1 Tetrahydropyridinyl- and piperidinyl Inhibitors of serotonin reuptake ELI LILLY AND COMPANY (US) 1999-12-22 EP 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-20040006229-A1 Indole derivatives for the treatment of depression and anxiety IDO1, TPH1, IDO2 SLC6A4 45/4885DRD2 41/4885SLC6A2 68/4885

“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.