SCHEMBL6846653

SCHEMBL6846653

COc1ccc(N2CCN(CC(O)Cn3cnc4ccccc43)CC2)cc1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.58
KMT2A Q03164 4/20 0.58
MAPK1 P28482 2/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
MAPT P10636 10/20 0.55
ALDH1A1 P00352 1/20 0.54
TP53 P04637 1/20 0.54
IDO1 P14902 1/20 0.54
AGER Q15109 2/20 0.52
LMNA P02545 3/20 0.52
HTT P42858 3/20 0.52
GAA P10253 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
GFER P55789 1/20 0.51
NPY1R P25929 1/20 0.51
NPY2R P49146 1/20 0.51

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
SCHEMBL6843571 0.90 KDR (0.60) MEN1KMT2AMAPK1L3MBTL1MAPT
SCHEMBL6839336 0.88 MAPT (0.54) MEN1KMT2AMAPK1MAPTALDH1A1
SCHEMBL6846881 0.88 DRD2 (0.64) MEN1KMT2AMAPK1MAPTIDO1
SCHEMBL6843585 0.87 DRD2 (0.54) MAPK1MAPTALDH1A1IDO1AGER
SCHEMBL6846647 0.86 DRD2 (0.53) MEN1KMT2AMAPK1MAPTIDO1
SCHEMBL6843898 0.86 DRD2 (0.53) KMT2AMAPK1MAPTAGERLMNA
SCHEMBL6844266 0.84 HTR7 (0.57) MEN1KMT2AMAPTALDH1A1AGER
SCHEMBL6846830 0.83 AGER (0.49) MEN1KMT2AMAPK1MAPTALDH1A1
SCHEMBL6839145 0.81 TDP1 (0.60) MAPTALDH1A1AGERLMNAHTT
SCHEMBL6843559 0.81 MAPT (0.55) MEN1KMT2AMAPK1MAPTALDH1A1

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 10 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
EP-0775118-B1 BENZIMIDAZOLE DERIVATIVES HAVING DOPAMINERGIC ACTIVITY PFIZER (US) 2003-06-04 EP 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 MEN1 4261/4885KMT2A 1418/4885MAPK1 2193/4885
US-20030158208-A1 Dopamine D4 ligands for the treatment of novelty-seeking disorders SLC6A3, DRD4, DRD2 MEN1 4261/4885KMT2A 1418/4885MAPK1 2193/4885

“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.