SCHEMBL7524691

SCHEMBL7524691

Fc1ccc2nc(NCCN3CCN(Cc4ccccc4)CC3)sc2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.50
NPC1 O15118 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
MAPT P10636 2/20 0.50
ACHE P22303 2/20 0.47
BCHE P06276 1/20 0.47
MAPK1 P28482 2/20 0.47
TP53 P04637 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
TSHR P16473 1/20 0.47
THPO P40225 1/20 0.47
MTOR P42345 1/20 0.47
HIF1A Q16665 1/20 0.47
MET P08581 1/20 0.46
LRRK2 Q5S007 1/20 0.46
NPY1R P25929 2/20 0.46
USP30 Q70CQ3 1/20 0.45
MEN1 O00255 2/20 0.45

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
SCHEMBL27565703 0.93 BCHE (0.54) RAB9ANPC1SMN1; SMN2MAPTACHE
Fumaric Acid SCHEMBL7528988 0.92 MAPT (0.54) RAB9ANPC1SMN1; SMN2MAPTACHE
Fumaric Acid SCHEMBL7528981 0.92 MAPT (0.54) RAB9ANPC1SMN1; SMN2MAPTACHE
SCHEMBL7526830 0.90 BCHE (0.49) MAPTACHEBCHEMAPK1CYP1A2
Bromide SCHEMBL7525128 0.89 BCHE (0.48) MAPTACHEBCHEMAPK1CYP1A2
SCHEMBL7522090 0.87 MAPT (0.50) RAB9ANPC1SMN1; SMN2MAPTACHE
Bromide SCHEMBL7523247 0.86 SLC27A1 (0.49) RAB9ANPC1SMN1; SMN2MAPTACHE
SCHEMBL7532200 0.84 CSNK1D (0.56) RAB9ANPC1SMN1; SMN2MAPTALOX12
Bromide SCHEMBL7527924 0.83 CSNK1D (0.55) RAB9ANPC1SMN1; SMN2MAPTALOX12
SCHEMBL7522052 0.82 SLC27A1 (0.52) RAB9ANPC1SMN1; SMN2MAPTACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020058666-A1 2-piperazinoalkylaminobenzoazole derivatives: dopamine receptor subtype specific ligands NEUROGEN CORPORATION 2002-05-16 US claimed
CN-1325397-A 2-piperazino alkylatnino benzoazole derivatives: dopamine receptor subtype sepcific ligands NEUROGEN CORP (US) 2001-12-05 CN claimed
WO-2000018767-A9 2-PIPERAZINO ALKYLAMINO BENZOAZOLE DERIVATIVES: DOPAMINE RECEPTOR SUBTYPE SPECIFIC LIGANDS NEUROGEN CORP (US) 2001-04-19 WO claimed
US-6432958-B1 FOR THERAPY AND PROPHYLAXIS OF NEUROPSYCHOLOGICAL DISORDERS SUCH AS SCHIZOPHRENIA, MANIA, DEMENTIA, DEPRESSION, ANXIETY, COMPULSIVE BEHAVIOR, SUBSTANCE ABUSE, MOTOR DISORDERS AND MOTION DISORDERS RELATED TO USE OF NEUROLEPTIC AGENT NEUROGEN CORPORATION 2002-08-13 US disclosed
US-20020058666-A1 2-piperazinoalkylaminobenzoazole derivatives: dopamine receptor subtype specific ligands NEUROGEN CORPORATION 2002-05-16 US disclosed
CN-1325397-A 2-piperazino alkylatnino benzoazole derivatives: dopamine receptor subtype sepcific ligands NEUROGEN CORP (US) 2001-12-05 CN disclosed
US-6284759-B1 PSYCHOLOGICAL DISORDERS; NERVOUS SYSTEM DISORDERS NEUROGEN CORPORATION 2001-09-04 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-20020058666-A1 2-piperazinoalkylaminobenzoazole derivatives: dopamine receptor subtype specific ligands CHRNA7, HTR7, OPRD1 RAB9A 1000/4885NPC1 2569/4885SMN1; SMN2 603/4885

“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.