SCHEMBL6784584

SCHEMBL6784584

CC(=O)c1ccc(-c2cccc3c2[C@@H]2CCNCC[C@@H]2N3)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.36
SLC6A4 P31645 2/20 0.36
CREBBP Q92793 5/20 0.35
BRD4 O60885 3/20 0.35
MAPT P10636 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
LMNA P02545 1/20 0.35
TSHR P16473 1/20 0.35
FYN P06241 1/20 0.34
OPRD1 P41143 1/20 0.33
SLC6A3 Q01959 1/20 0.33
AGTR1 P30556 1/20 0.33
CHRM1 P11229 1/20 0.32
HSD17B1 P14061 2/20 0.32
ALDH1A1 P00352 1/20 0.32
MEN1 O00255 1/20 0.32
CYP2D6 P10635 1/20 0.32
KMT2A Q03164 1/20 0.32
CHRM3 P20309 1/20 0.32
CHEK1 O14757 1/20 0.32

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
SCHEMBL6784586 1.00 SLC6A2 (0.36) SLC6A2SLC6A4CREBBPBRD4MAPT
SCHEMBL6787068 0.88 FYN (0.46) SLC6A2SLC6A4CREBBPBRD4FYN
SCHEMBL6787072 0.88 FYN (0.46) SLC6A2SLC6A4CREBBPBRD4FYN
SCHEMBL6786361 0.84 KDM1A (0.36) LMNATSHROPRD1MEN1CYP2D6
SCHEMBL6786365 0.84 KDM1A (0.36) LMNATSHROPRD1MEN1CYP2D6
SCHEMBL6791321 0.82 HRH1 (0.42) SLC6A2SLC6A4CREBBPBRD4LMNA
SCHEMBL6791319 0.82 HRH1 (0.42) SLC6A2SLC6A4CREBBPBRD4LMNA
SCHEMBL6785602 0.81 HTR7 (0.40) SLC6A2SLC6A4LMNATSHRSLC6A3
SCHEMBL6785604 0.81 HTR7 (0.40) SLC6A2SLC6A4LMNATSHRSLC6A3
Maleic Acid SCHEMBL6782500 0.81 HRH1 (0.39) SLC6A2SLC6A4LMNATSHRSLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6828314-B2 Modulation of the activity of serotonin receptors (5-HT) to treat diseases such as anxiety, depression or obesity PFIZER 2004-12-07 US disclosed
US-20030225058-A1 Substituted azepino[4,5b]indoline derivatives PHARMACIA & UPJOHN COMPANY 2003-12-04 US disclosed
US-6586421-B2 For therapy of central nervous system, including diseases, disorders, and conditions related to, such as anxiety, depression, hypertension, migraine, obesity, compulsive disorders, schizophrenia, autism, neurodegenerative disorders PHARMACIA & UPJOHN COMPANY 2003-07-01 US disclosed
US-20020077318-A1 Substituted azepino[4,5b] indoline derivatives PHARMACIA & UPJOHN COMPANY 2002-06-20 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 (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-20030225058-A1 Substituted azepino[4,5b]indoline derivatives HTR5A, HTR1A, HTR4 SLC6A2 104/4885SLC6A4 21/4885CREBBP 3464/4885
US-20020077318-A1 Substituted azepino[4,5b] indoline derivatives HTR5A, HTR1A, HTR4 SLC6A2 104/4885SLC6A4 21/4885CREBBP 3464/4885

“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.