SCHEMBL5756400

SCHEMBL5756400

Fc1ccc2sc(C3=CCNCC3)cc2c1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 6/20 0.44
HTR2C P28335 4/20 0.44
HTR2A P28223 1/20 0.44
HTR7 P34969 1/20 0.44
SIGMAR1 Q99720 2/20 0.39
DRD2 P14416 1/20 0.38
QDPR P09417 2/20 0.37
CDK9 P50750 2/20 0.37
CCNT1 O60563 1/20 0.37
KIT P10721 1/20 0.37

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
SCHEMBL5758301 0.89 HTR6 (0.44) HTR6HTR2CHTR2AHTR7SIGMAR1
SCHEMBL7867297 0.83 SIGMAR1 (0.51) HTR6HTR2CHTR2AHTR7SIGMAR1
SCHEMBL4359750 0.81 SIGMAR1 (0.50) HTR2CSIGMAR1DRD2QDPR
Hydrochloric Acid SCHEMBL8321976 0.79 HTR2C (0.51) HTR2CSIGMAR1DRD2QDPR
Oxalic Acid SCHEMBL7865026 0.77 SIGMAR1 (0.44) HTR6HTR2CHTR2AHTR7SIGMAR1
SCHEMBL7870752 0.75 QDPR (0.42) HTR6HTR2CHTR7QDPRCDK9
SCHEMBL7864911 0.74 SIGMAR1 (0.51) HTR6HTR2CHTR2AHTR7SIGMAR1
SCHEMBL5760127 0.74 HTR2C (0.43) HTR6HTR2CHTR2AHTR7SIGMAR1
SCHEMBL6312184 0.73 QDPR (0.55) HTR6HTR2CHTR2AHTR7SIGMAR1
SCHEMBL6312469 0.71 HTR6 (0.49) HTR6HTR2CHTR2AHTR7DRD2

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-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

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 HTR6 10/4885HTR2C 13/4885HTR2A 25/4885

“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.