SCHEMBL6772142

SCHEMBL6772142

OC(COc1cccc2[nH]ccc12)CN1CCN(c2cccc3[nH]ccc23)CC1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.59
MAPK1 P28482 3/20 0.59
KDM4E B2RXH2 3/20 0.59
NPSR1 Q6W5P4 1/20 0.59
HTR1A P08908 14/20 0.58
SLC6A4 P31645 5/20 0.58
LMNA P02545 4/20 0.58
TDP1 Q9NUW8 2/20 0.58
MEN1 O00255 2/20 0.58
KMT2A Q03164 2/20 0.58
HIF1A Q16665 2/20 0.58
ADRB1 P08588 2/20 0.58
NR1I2 O75469 1/20 0.58
NR3C1 P04150 1/20 0.58
ADRA2A P08913 1/20 0.58
DRD2 P14416 1/20 0.58
ADRA2B P18089 1/20 0.58
ADRA2C P18825 1/20 0.58
DRD1 P21728 1/20 0.58
ACHE P22303 1/20 0.58

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
Hydrochloric Acid SCHEMBL7885529 0.92 MAPT (0.67) MAPTMAPK1KDM4ENPSR1HTR1A
SCHEMBL6778522 0.91 MAPT (0.65) MAPTMAPK1KDM4ENPSR1HTR1A
Hydrochloric Acid SCHEMBL7887645 0.90 MAPT (0.73) MAPTMAPK1KDM4EHTR1ASLC6A4
Hydrochloric Acid SCHEMBL7885717 0.90 MAPT (0.73) MAPTMAPK1KDM4EHTR1ASLC6A4
SCHEMBL7883003 0.90 ABCB1 (0.65) MAPTMAPK1KDM4EHTR1ASLC6A4
SCHEMBL6772718 0.89 MAPT (0.52) MAPTMAPK1KDM4ENPSR1HTR1A
SCHEMBL6777581 0.89 ADRB1 (0.53) MAPTMAPK1KDM4ENPSR1HTR1A
SCHEMBL8433535 0.88 SCN9A (0.56) MAPTMAPK1KDM4ENPSR1HTR1A
SCHEMBL7881247 0.88 MAPT (0.54) MAPTMAPK1KDM4ENPSR1HTR1A
SCHEMBL6776715 0.87 CACNA1G (0.57) MAPTLMNAMEN1KMT2AKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020035112-A1 Antipsychotic indolyl derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 2002-03-21 US claimed
EP-1076647-A2 ANTIPSYCHOTIC INDOLYL DERIVATIVES AMERICAN HOME PRODUCTS CORPORATION (US) 2001-02-21 EP claimed
WO-1999055672-A2 ANTIPSYCHOTIC INDOLYL DERIVATIVES AMERICAN HOME PRODUCTS CORPORATION (US) 1999-11-04 WO claimed
US-6689792-B2 USEFUL FOR THE TREATMENT OF SCHIZOPHRENIA AND RELATED PSYCHOTIC DISORDERS SUCH AS PARKINSON'S DISEASE AND ALZHEIMER'S DISEASE WYETH 2004-02-10 US disclosed
US-20020035112-A1 Antipsychotic indolyl derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 2002-03-21 US disclosed
US-6310066-B1 1-(4-CHLORO-PHENOXY)-3-(4-(1H-INDOL-4-YL)-PIPERAZIN-1-YL)-PROPAN-2-OL FOR EXAMPLE AMERICAN HOME PRODUCTS CORP. 2001-10-30 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-20020035112-A1 Antipsychotic indolyl derivatives DRD4, HTR4, DBH MAPT 2752/4885MAPK1 1772/4885KDM4E 1633/4885

“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.