SCHEMBL6843885

SCHEMBL6843885

O=c1[nH]c2cc(Cl)ccc2n1CC(O)CN1CCN(c2ccc(F)cc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 4/20 0.52
HTR7 P34969 4/20 0.52
DRD2 P14416 3/20 0.52
SMN1; SMN2 Q16637 2/20 0.50
HPGD P15428 2/20 0.49
LMNA P02545 2/20 0.49
POLB P06746 1/20 0.49
MAPK1 P28482 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
KCNH2 Q12809 3/20 0.48
MAPT P10636 3/20 0.47
PLD2 O14939 1/20 0.47
PLD1 Q13393 1/20 0.47
TDP1 Q9NUW8 1/20 0.46

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
SCHEMBL6843595 0.92 HTR1A (0.50) HTR1AHTR7DRD2SMN1; SMN2HPGD
SCHEMBL6844249 0.73 HTR1A (0.49) HTR1AHTR7DRD2LMNAMAPK1
SCHEMBL6974244 0.73 DRD2 (0.55) HTR1AHTR7DRD2LMNAKCNH2
SCHEMBL11196364 0.72 P2RX7 (0.61) HTR1AHTR7DRD2SMN1; SMN2LMNA
SCHEMBL14349463 0.71 DRD2 (0.70) HTR1ADRD2LMNAMAPK1KCNH2
SCHEMBL5026887 0.71 BAX (0.63) SMN1; SMN2LMNAMAPK1MAPTTDP1
SCHEMBL6967924 0.70 HTR1A (0.49) HTR1AHTR7SMN1; SMN2HPGDLMNA
SCHEMBL12124686 0.69 SLC6A2 (0.67) HTR7SMN1; SMN2HPGDLMNAPOLB
SCHEMBL6965271 0.69 HTR1A (0.48) HTR1AHTR7DRD2LMNAMAPT
SCHEMBL13875129 0.69 MEN1 (0.62) HTR1AHTR7DRD2SMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0775118-B1 BENZIMIDAZOLE DERIVATIVES HAVING DOPAMINERGIC ACTIVITY PFIZER (US) 2003-06-04 EP claimed
US-20040116443-A1 Dopamine D4 ligands for the treatment of novelty-seeking disorders PFIZER INC 2004-06-17 US disclosed
US-20030158208-A1 Dopamine D4 ligands for the treatment of novelty-seeking disorders PFIZER INC. 2003-08-21 US disclosed
US-6548502-B2 Preventing disorder selected from pathological gambling, attention deficit disorder with hyperactivity disorder, substance addiction such as drug and alcohol and sex in a mammals by administering pyrido(1,2-a) pyrazine derivatives PFIZER INC 2003-04-15 US disclosed
US-20020049209-A1 Dopamine D4 ligands for the treatment of novelty-seeking disorders PFIZER INC. 2002-04-25 US disclosed
EP-1177792-A2 Dopamine D4 Ligands for the treatment of novelty-seeking disorders Pfizer Products Inc. (US) 2002-02-06 EP disclosed
US-5889010-A PSYCHOLOGICAL DISORDERS; UROGENITAL DISORDERS; COGNITION ACTIVATORS; NERVOUS SYSTEM DISORDERS; VISION DEFECTS; CONGESTIVE HEART FAILURE; DRUG ABRUSE; PARKINSON'S DISEASE;ANTIINFLAMMATORY AGENTS; ANTIALLERGENS PFIZER INC. (US) 1999-03-30 US disclosed
EP-0775118-A1 BENZIMIDAZOLE DERIVATIVES HAVING DOPAMINERGIC ACTIVITY PFIZER INC. (US) 1997-05-28 EP disclosed
WO-1996004250-A1 BENZIMIDAZOLE DERIVATIVES HAVING DOPAMINERGIC ACTIVITY PFIZER INC. (US) 1996-02-15 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-20020049209-A1 Dopamine D4 ligands for the treatment of novelty-seeking disorders SLC6A3, DRD4, DRD2 HTR1A 85/4885HTR7 152/4885DRD2 3/4885
US-20030158208-A1 Dopamine D4 ligands for the treatment of novelty-seeking disorders SLC6A3, DRD4, DRD2 HTR1A 85/4885HTR7 152/4885DRD2 3/4885

“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.