SCHEMBL4563151

SCHEMBL4563151

CCC(N(C(=O)C1CCCCC1)c1ccccn1)N1CCNCC1c1cccc2[nH]ccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 7/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
SMN1; SMN2 Q16637 3/20 0.36
LMNA P02545 2/20 0.36
ADRA1A P35348 6/20 0.35
DRD4 P21917 5/20 0.35
ADRA1B P35368 5/20 0.35
HTR7 P34969 3/20 0.35
HTR2B P41595 3/20 0.35
HTR2A P28223 2/20 0.35
OPRD1 P41143 1/20 0.34
ADRA1D P25100 3/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
TSHR P16473 1/20 0.34
HTR1B P28222 1/20 0.34
OPRM1 P35372 2/20 0.32
OPRK1 P41145 1/20 0.32
BLM P54132 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
SCHEMBL4424772 1.00 HTR1A (0.39) HTR1AMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL8783440 0.85 HTR1A (0.48) HTR1AMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL8136251 0.85 HTR1A (0.48) HTR1AMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL8129133 0.85 OPRM1 (0.46) HTR1AMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL8543106 0.71 OPRM1 (0.62) HTR1ASMN1; SMN2LMNAADRA1ADRD4
SCHEMBL6429257 0.67 HTR1A (0.47) HTR1AMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL13533329 0.67 OPRM1 (0.55) HTR1AMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL13533328 0.67 OPRM1 (0.55) HTR1AMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL6546338 0.65 HTR1A (0.72) HTR1AMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL8120514 0.65 HTR1A (0.42) HTR1AMEN1KMT2ASMN1; 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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2026783-A2 METHOD FOR ENHANCING COGNITIVE FUNCTION Wyeth a Corporation of the State of Delaware (US) 2009-02-25 EP claimed
WO-2007146073-A2 METHOD FOR ENHANCING COGNITIVE FUNCTION WYETH (US) 2007-12-21 WO claimed
US-20060287335-A1 Serotonergic agents for treating sexual dysfunction WYETH (US) 2006-12-21 US claimed
EP-1534258-A2 AGONISM OF THE 5HT 2a RECEPTOR FOR TREATMENT OF THERMOREGULATORY DYSFUNCTION Wyeth (US) 2005-06-01 EP claimed
US-20040063721-A1 Agonism of the 5HT2A receptor for treatment of thermoregulatory dysfunction WYETH 2004-04-01 US claimed
WO-2004016256-A2 AGONISM OF THE 5HT2a RECEPTOR FOR TREATMENT OF THERMOREGULATORY DYSFUNCTION WYETH (US) 2004-02-26 WO claimed
EP-0763031-B1 PIPERAZINE DERIVATIVES AS 5HT1A ANTAGONISTS WYETH JOHN & BROTHER LTD (GB) 2000-05-10 EP claimed
EP-0763031-A1 PIPERAZINE DERIVATIVES AS 5HT1A ANTAGONISTS JOHN WYETH & BROTHER LIMITED (GB) 1997-03-19 EP claimed
WO-1995033743-A1 PIPERAZINE DERIVATIVES AS 5HT1A ANTAGONISTS JOHN WYETH & BROTHER LIMITED (GB) 1995-12-14 WO claimed
EP-1971337-A1 SEROTONERGIC AGENTS FOR TREATING SEXUAL DYSFUNCTION Wyeth a Corporation of the State of Delaware (US) 2008-09-24 EP disclosed
US-7425558-B2 -4-substituted-N-(2-(4-(2,3-dihydro-benzo(1,4)dioxin-5-yl)-piperazin -1-yl)propy l)-N-pyridin-2-yl-benzamide or salts; 5-HT1A receptor antagonists; urinary incontinence WYETH (US) 2008-09-16 US disclosed
US-20080070925-A1 SEROTONERGIC AGENTS FOR TREATING SEXUAL DYSFUNCTION WYETH LLC 2008-03-20 US disclosed
WO-2007081374-A1 SEROTONERGIC AGENTS FOR TREATING SEXUAL DYSFUNCTION WYETH (US) 2007-07-19 WO disclosed
US-20060287333-A1 Serotonergic agents for treating sexual dysfunction WYETH (US) 2006-12-21 US disclosed
US-20060287335-A1 Serotonergic agents for treating sexual dysfunction WYETH (US) 2006-12-21 US disclosed
EP-1534258-A2 AGONISM OF THE 5HT 2a RECEPTOR FOR TREATMENT OF THERMOREGULATORY DYSFUNCTION Wyeth (US) 2005-06-01 EP disclosed
US-20040063721-A1 Agonism of the 5HT2A receptor for treatment of thermoregulatory dysfunction WYETH 2004-04-01 US disclosed
WO-2004016256-A2 AGONISM OF THE 5HT2a RECEPTOR FOR TREATMENT OF THERMOREGULATORY DYSFUNCTION WYETH (US) 2004-02-26 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 (3 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-20060287335-A1 Serotonergic agents for treating sexual dysfunction HTR5A, HTR1A, HTR3A HTR1A 2/4885MEN1 3526/4885KMT2A 3795/4885
US-20060287333-A1 Serotonergic agents for treating sexual dysfunction HTR5A, HTR1A, HTR3A HTR1A 2/4885MEN1 3526/4885KMT2A 3795/4885
US-20080070925-A1 SEROTONERGIC AGENTS FOR TREATING SEXUAL DYSFUNCTION HTR5A, HTR1A, HTR3A HTR1A 2/4885MEN1 3526/4885KMT2A 3795/4885

“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.