SCHEMBL7214491

SCHEMBL7214491

CC(=O)N1CC(CCN2CCN(c3c[nH]c4cc(Cl)ccc34)CC2)c2cc(F)ccc21

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR1D P28221 2/20 0.48
HTR1B P28222 2/20 0.48
DRD2 P14416 10/20 0.46
HTR2A P28223 5/20 0.46
HTR1A P08908 3/20 0.46
DRD3 P35462 4/20 0.40
DRD1 P21728 2/20 0.40
HTR7 P34969 6/20 0.38
SLC6A4 P31645 3/20 0.38
SIGMAR1 Q99720 3/20 0.38
DRD4 P21917 2/20 0.38
HTR2C P28335 2/20 0.38
AVPR1A P37288 1/20 0.37
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
KCNH2 Q12809 2/20 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
SCHEMBL7214607 0.89 DRD2 (0.58) HTR1DHTR1BDRD2HTR2AHTR1A
SCHEMBL7220848 0.88 DRD2 (0.53) HTR1DHTR1BDRD2HTR2AHTR1A
SCHEMBL7220921 0.84 HTR1D (0.52) HTR1DHTR1BDRD2HTR2AHTR1A
SCHEMBL7219334 0.83 DRD2 (0.42) DRD2HTR2AHTR1ADRD3DRD1
SCHEMBL7220227 0.81 HTR1A (0.55) HTR1DHTR1BDRD2HTR2AHTR1A
SCHEMBL7219624 0.76 DRD2 (0.51) HTR1DHTR1BDRD2HTR2AHTR1A
SCHEMBL7214377 0.76 HTR2A (0.51) DRD2HTR2AHTR1AHTR7SLC6A4
SCHEMBL7219780 0.76 HTR1D (0.51) HTR1DHTR1BDRD2HTR2AHTR1A
SCHEMBL7216050 0.76 HTR1D (0.54) HTR1DHTR1BDRD2HTR1AHTR7
SCHEMBL7219376 0.75 HTR1D (0.52) HTR1DHTR1BDRD2HTR1AHTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1282644-C Indane or indoline derivative LUNDBECK & CO AS H (DK) 2006-11-01 CN disclosed
CN-1244558-C 1,2-indane or indoline derivative LUNDBECK & CO AS H (DK) 2006-03-08 CN disclosed
CN-1515551-A 1,2-indane or indoline derivative H.¡�±������޹�˾ 2004-07-28 CN disclosed
CN-1495165-A Indane or indoline derivative H.¡�±������޹�˾ 2004-05-12 CN disclosed
CN-1146556-C 1, 2-indane or indoline derivative and preparation method and application thereof H.¡�±������޹�˾ 2004-04-21 CN disclosed
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
CN-1246117-A 1, 2-indane or indoline derivatives LUNDBECK & CO AS H (DK) 2000-03-01 CN 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 HTR1D 4/4885HTR1B 24/4885DRD2 14/4885
US-20010021777-A1 Indane or dihydroindole derivatives HTR4, GPR4, GPR174 HTR1D 4/4885HTR1B 24/4885DRD2 14/4885

“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.