SCHEMBL7214533

SCHEMBL7214533

ICCC1Cc2ccccc2C1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 3/20 0.53
CYP19A1 P11511 2/20 0.44
ADRA2A P08913 1/20 0.39
SIGMAR1 Q99720 1/20 0.37
DRD3 P35462 2/20 0.36
HTR2A P28223 2/20 0.36
HRH1 P35367 1/20 0.36
HTR1A P08908 1/20 0.36
DRD2 P14416 1/20 0.36
SLC6A4 P31645 1/20 0.36
HTR7 P34969 1/20 0.36
HTR2B P41595 1/20 0.36
PLAU P00749 1/20 0.35
PNMT P11086 1/20 0.35

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
SCHEMBL1800050 0.80 IDO1 (0.47) IDO1CYP19A1ADRA2ASIGMAR1DRD3
SCHEMBL17956326 0.76 IDO1 (0.53) IDO1CYP19A1ADRA2ASIGMAR1DRD3
SCHEMBL6992991 0.76 IDO1 (0.59) IDO1CYP19A1HTR2AHRH1SLC6A4
SCHEMBL29633580 0.76 IDO1 (0.53) IDO1CYP19A1ADRA2ASIGMAR1DRD3
SCHEMBL5724900 0.76 IDO1 (0.53) IDO1CYP19A1ADRA2ASIGMAR1DRD3
SCHEMBL3916886 0.76 FYN (0.57) IDO1CYP19A1ADRA2ADRD3HTR2A
SCHEMBL1338863 0.76 IDO1 (0.53) IDO1CYP19A1ADRA2ASIGMAR1DRD3
SCHEMBL31536940 0.76 IDO1 (0.59) IDO1CYP19A1HTR2AHRH1SLC6A4
SCHEMBL9933773 0.75 IDO1 (0.47) IDO1CYP19A1ADRA2ASIGMAR1DRD3
Hydrochloric Acid SCHEMBL7212472 0.74 IDO1 (0.62) IDO1CYP19A1HTR2AHRH1SLC6A4

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-6552044-B2 Dopamine receptors H. LUNDBECK A/S (DK) 2003-04-22 US disclosed
EP-0946542-B1 INDANE OR DIHYDROINDOLE DERIVATIVES LUNDBECK & CO AS H (DK) 2002-10-09 EP disclosed
US-6352988-B2 HIGH AFFINITY FOR D4 RECEPTORS; TREATMENT OF SCHIZOPHRENIA, OTHER PSYCHOSES, ANXIETY DISORDERS, DEPRESSION, ALCOHOL ABUSE, IMPULSE CONTROL DISORDERS, AGGRESSION H. LUNDBECK A/S (DK) 2002-03-05 US disclosed
US-20010021777-A1 Indane or dihydroindole derivatives H. LUNDBECK A/S (DK) 2001-09-13 US disclosed
US-20010020095-A1 Indane or dihydroindole derivatives H. LUNDBECK A/S (DK) 2001-09-06 US disclosed
US-6262087-B1 HAVE HIGH AFFINITY FOR D4 RECEPTORS; USEFUL IN THE TREATMENT OF CERTAIN PSYCHIATRIC AND NEUROLOGIC DISORDERS, INCLUDING PSYCHOSIS, DEPRESSION AND ANXIETY. H. LUNDBECK A/S (DK) 2001-07-17 US disclosed
EP-0946542-A1 INDANE OR DIHYDROINDOLE DERIVATIVES H. LUNDBECK A/S (DK) 1999-10-06 EP disclosed
WO-1998028293-A1 INDANE OR DIHYDROINDOLE DERIVATIVES H.LUNDBECK A/S (DK) 1998-07-02 WO 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-20010020095-A1 Indane or dihydroindole derivatives HTR4, GPR4, GPR174 IDO1 35/4885CYP19A1 474/4885ADRA2A 37/4885
US-20010021777-A1 Indane or dihydroindole derivatives HTR4, GPR4, GPR174 IDO1 35/4885CYP19A1 474/4885ADRA2A 37/4885

“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.