SCHEMBL3266427

SCHEMBL3266427

c1ccc(Oc2cccc(N3CCNCC3)n2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR3E A5X5Y0 3/20 0.54
HTR3B O95264 3/20 0.54
HTR3A P46098 3/20 0.54
HTR3D Q70Z44 3/20 0.54
HTR3C Q8WXA8 3/20 0.54
ALDH1A1 P00352 2/20 0.54
LTA4H P09960 1/20 0.54
SLC6A2 P23975 7/20 0.51
SLC6A4 P31645 6/20 0.51
SLC6A3 Q01959 6/20 0.51
HTR1A P08908 5/20 0.51
ADRB1 P08588 4/20 0.49
HTR6 P50406 2/20 0.49
KDM4E B2RXH2 2/20 0.49
CYP3A4 P08684 2/20 0.49
HSD17B10 Q99714 2/20 0.49
USP2 O75604 1/20 0.49
CYP1A2 P05177 1/20 0.49
HTR2C P28335 1/20 0.49
MAPK1 P28482 1/20 0.49

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
SCHEMBL6793743 0.87 HTR3A (0.57) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL6793111 0.87 HTR3A (0.53) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL6791132 0.85 HTR3A (0.55) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL3267100 0.82 HTR2C (0.55) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL6378463 0.82 POLB (0.56) ALDH1A1SLC6A2SLC6A4SLC6A3KDM4E
SCHEMBL6794736 0.80 HTR3E (0.56) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL2412819 0.80 HTR3E (0.58) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL10969589 0.79 LTA4H (0.54) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL3104344 0.78 HTR2C (0.57) HTR3EHTR3BHTR3AHTR3DHTR3C
Hydrochloric Acid SCHEMBL3849292 0.78 HTR3E (0.57) HTR3EHTR3BHTR3AHTR3DHTR3C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1335907-B1 PIPERAZINYLPYRAZINE COMPOUNDS AS AGONIST OR ANTAGONIST OF SEROTONIN 5HT-2 RECEPTOR BIOVITRUM AB PUBL (SE) 2010-06-09 EP disclosed
US-7247633-B2 Pyrimidine compounds and their use BIOVITRUM AB (SE) 2007-07-24 US disclosed
US-7229997-B2 Compounds and their use BIOVITRUM AB (SE) 2007-06-12 US disclosed
EP-1506185-B1 COMPOUNDS AND THEIR USE AS INHIBITORS OF 5-HT BIOVITRUM AB (SE) 2006-05-24 EP disclosed
EP-1506185-A1 NOVEL COMPOUNDS AND THEIR USE Biovitrum AB (SE) 2005-02-16 EP disclosed
US-20040014767-A1 Novel compounds and their use BIOVITRUM AB, A SWEDISH CORPORATION 2004-01-22 US disclosed
US-20030232814-A1 Novel compounds and their use BIOVITRUM AB (PUBL) (SE) 2003-12-18 US disclosed
WO-2003097636-A1 NOVEL COMPOUNDS AND THEIR USE BIOVITRUM AB (SE) 2003-11-27 WO disclosed
EP-1335907-A1 PIPERAZINYLPYRAZINE COMPOUNDS AS AGONIST OR ANTAGONIST OF SEROTONIN 5HT-2 RECEPTOR BIOVITRUM AB (SE) 2003-08-20 EP disclosed
US-6593330-B2 Central nervous system disorders; antiserotonine agents BIOVITRUM (SE) 2003-07-15 US disclosed
US-20020147200-A1 Novel compounds and their use PROXIMAGEN NEUROSCIENCE PLC (GB) 2002-10-10 US disclosed
WO-2002040456-A1 PIPERAZINYLPYRAZINE COMPOUNDS AS AGONIST OR ANTAGONIST OF SEROTONIN 5HT-2 RECEPTOR BIOVITRUM AB (SE) 2002-05-23 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-20030232814-A1 Novel compounds and their use GPR119, FABP4, MC4R HTR3E 373/4885HTR3B 185/4885HTR3A 294/4885
US-20020147200-A1 Novel compounds and their use BRIX1, UGT1A1, NR5A1 HTR3E 2506/4885HTR3B 1922/4885HTR3A 1862/4885
US-20040014767-A1 Novel compounds and their use BRIX1, UGT1A1, NR5A1 HTR3E 2506/4885HTR3B 1922/4885HTR3A 1862/4885

“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.